SCHEMBL67105

SCHEMBL67105

CC(C)(C)c1ccc(-c2ccc(-c3cc[c]cc3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.56
TSHR P16473 1/20 0.46
LMNA P02545 2/20 0.44
TYR P14679 1/20 0.44
HTR1D P28221 1/20 0.42
ADRA1A P35348 1/20 0.42
NISCH Q9Y2I1 1/20 0.42
XDH P47989 1/20 0.42
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.37
TP53 P04637 2/20 0.37
KMT2A Q03164 2/20 0.37
MITF O75030 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
IKBKB O14920 1/20 0.37
DGAT1 O75907 1/20 0.36
NOTUM Q6P988 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL445400 1.00 KIF11 (0.56) KIF11TSHRLMNATYRHTR1D
SCHEMBL29050790 0.84 RXRB (0.53) KIF11KDM4E
SCHEMBL21735 0.84 TSHR (0.48) KIF11TSHRLMNATYRNPC1
Water SCHEMBL28104416 0.84 TSHR (0.48) KIF11TSHRLMNATYRNPC1
SCHEMBL26915 0.84 KIF11 (0.70) KIF11TSHRLMNATYRHTR1D
SCHEMBL3423876 0.84 KIF11 (0.70) KIF11TSHRLMNATYRHTR1D
SCHEMBL5823988 0.83 NPC1 (0.60) KIF11XDHNPC1RAB9AKDM4E
SCHEMBL27420151 0.81 TSHR (0.46) KIF11TSHRLMNATYRNPC1
SCHEMBL27389069 0.81 TSHR (0.46) KIF11TSHRLMNATYRNPC1
SCHEMBL27497107 0.81 TSHR (0.46) KIF11TSHRLMNATYRNPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1408 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12041848-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2024-07-16 US claimed
EP-3378853-B1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEMICAL LTD (KR) 2024-04-17 EP claimed
US-11877509-B2 Organic light-emitting element LG CHEM, LTD. 2024-01-16 US claimed
US-RE49118-E1 Material for organic electroluminescence device and electroluminescence device employing the same IDEMITSU KOSAN CO., LTD. (JP) 2022-06-28 US claimed
EP-3388438-B1 SPIRO-STRUCTURED COMPOUND AND ORGANIC ELECTRONIC DEVICE COMPRISING SAME LG CHEMICAL LTD (KR) 2021-08-11 EP claimed
EP-3339293-B1 COMPOUND AND ORGANIC ELECTRONIC DEVICE COMPRISING SAME LG CHEMICAL LTD (KR) 2021-08-11 EP claimed
EP-3305765-B1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEMICAL LTD (KR) 2021-08-04 EP claimed
US-11081650-B2 Spiro compound and organic light-emitting element comprising same LG CHEM, LTD. 2021-08-03 US claimed
US-11050026-B2 Spiro compound and organic light-emitting element comprising same LG CHEM, LTD. 2021-06-29 US claimed
US-11031560-B2 Compound and organic electronic element comprising same LG CHEM, LTD. (KR) 2021-06-08 US claimed
US-8568902-B2 Asymmetric monoanthracene derivative, material for organic electroluminescent device and organic electroluminescent device utilizing the same IDEMITSU KOSAN CO., LTD. (JP) 2013-10-29 US claimed
EP-2218706-B1 BENZOPHENANTHRENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE EMPLOYING THE SAME IDEMITSU KOSAN CO (JP) 2013-08-21 EP claimed
US-20120112176-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-05-10 US claimed
US-8101290-B2 Organic compound having electron-transporting and/or hole-blocking performance and its use and OLEDs comprising the compound TECHNICAL INSTITUTE OF PHYSICS AND CHEMISTRY OF CHINESE ACADEMY OF SCIENCES (CN) 2012-01-24 US claimed
US-8044222-B2 Reduces the operating voltage and inhibits the molecules from being crystallized by using an aromatic amine derivative having an oxygen substituent for a hole transporting material; enhances yield in device, improves lifetime IDEMITSU KOSAN CO., LTD. (JP) 2011-10-25 US claimed
US-20100277063-A1 FLUORENE-BASED DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2010-11-04 US claimed
US-7781628-B2 Fluorene-based derivative and organic electroluminescence device employing the same IDEMITSU KOSAN CO., LTD. (JP) 2010-08-24 US claimed
US-7560604-B2 Biphenyl derivative, material for organic electroluminescence device, and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2009-07-14 US claimed
US-20090102356-A1 NOVEL ORGANIC COMPOUND HAVING ELECTRON-TRANSPORTING AND/OR HOLE-BLOCKING PERFORMANCE AND ITS USE AND OLEDs COMPRISING THE COMPOUND TECHNICAL INSTITUTE OF PHYSICS AND CHEMISTRY OF CHINESE ACADEMY OF SCIENCES (CN) 2009-04-23 US claimed
US-20070152565-A1 Light-emitting material for organic electroluminescent device, organic electroluminescent device using same, and material for organic electroluminescent device IDEMITSU KOSAN CO., LTD. (JP) 2007-07-05 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100277063-A1 FLUORENE-BASED DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME LEF1, FLNA, AFF2 KIF11 2291/4885TSHR 4045/4885LMNA 898/4885
US-11031560-B2 Compound and organic electronic element comprising same OR10J3, ESR1, ETV6 KIF11 2230/4885TSHR 4364/4885LMNA 4004/4885
US-12041848-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, NR2E3 KIF11 2816/4885TSHR 3741/4885LMNA 2975/4885
US-11081650-B2 Spiro compound and organic light-emitting element comprising same RER1, NR2E3, RIF1 KIF11 2158/4885TSHR 504/4885LMNA 2345/4885
US-11877509-B2 Organic light-emitting element CRY1, CRY2, NR2E3 KIF11 3607/4885TSHR 2662/4885LMNA 3261/4885
US-20090102356-A1 NOVEL ORGANIC COMPOUND HAVING ELECTRON-TRANSPORTING AND/OR HOLE-BLOCKING PERFORMANCE AND ITS USE AND OLEDs COMPRISING THE COMPOUND SLCO4C1, SLCO1B1, SLCO2B1 KIF11 724/4885TSHR 3165/4885LMNA 2530/4885
US-20070152565-A1 Light-emitting material for organic electroluminescent device, organic electroluminescent device using same, and material for organic electroluminescent device L1CAM, EBPL, APOL1 KIF11 4033/4885TSHR 4841/4885LMNA 763/4885
US-11050026-B2 Spiro compound and organic light-emitting element comprising same NR2E3, CRY1, ERG KIF11 1271/4885TSHR 2683/4885LMNA 2461/4885
US-20120112176-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME EML4, DDC, ALKBH2 KIF11 1627/4885TSHR 4439/4885LMNA 2124/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.