Sugi Predict

Sugi Predict / Compounds / SCHEMBL982672

SCHEMBL982672

SCHEMBL982672

Cc1ccc(C)c(Cc2c3ccccc3c(Cc3cc(C)ccc3C)c3ccccc23)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.47
▸ TAAR1 Q96RJ0 1/20 0.47
▸ TP53 P04637 2/20 0.43
▸ CYP1A2 P05177 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ MEN1 O00255 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ TACR1 P25103 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ TSHR P16473 2/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ KIF11 P52732 1/20 0.37
▸ TNF P01375 1/20 0.37

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
SCHEMBL985594 0.84 CYP1A2 (0.41) TP53CYP1A2NPC1RAB9AMEN1
SCHEMBL8094059 0.82 GAA (0.49) GAATAAR1CYP1A2NPC1RAB9A
SCHEMBL5252725 0.80 TAAR1 (0.60) GAATAAR1TP53CYP1A2NPC1
SCHEMBL8086482 0.79 TAAR1 (0.50) GAATAAR1NPC1RAB9AMEN1
SCHEMBL5606794 0.79 GAA (0.34) GAATAAR1TP53TSHRCYP3A4
SCHEMBL981458 0.78 GAA (0.40) GAATAAR1CYP1A2NPC1RAB9A
SCHEMBL1276089 0.78 CYP3A4 (0.57) GAATAAR1NPC1RAB9AMEN1
SCHEMBL28261729 0.76 CYP2A6 (0.42) GAATAAR1TP53CYP1A2NPC1
SCHEMBL5551682 0.74 TAAR1 (0.54) GAATAAR1NPC1RAB9AALDH1A1
SCHEMBL3440599 0.73 TAAR1 (0.44) GAATAAR1TP53NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1786885-B1 ELECTROLUMINESCENT MATERIALS AND DEVICES MERCK PATENT GMBH (DE) 2011-05-18 — — EP claimed
US-20080113215-A1 Electroluminescent Materials and Devices MERCK PATENT GMBH (DE) 2008-05-15 — — US claimed
US-20070252108-A1 Electroluminescent Materials and Devices MERCK PATENT GMBH (DE) 2007-11-01 — — US claimed
EP-2984079-B1 HETEROCYCLIC COMPOUNDS AND THEIR USE IN ELECTRO-OPTICAL OR OPTO-ELECTRONIC DEVICES POWER OLEDS LTD (GB) 2020-07-01 — — EP disclosed
US-10439147-B2 Heterocyclic compounds and their use in electro-optical or opto-electronic devices POWER OLEDS LIMITED (GB) 2019-10-08 — — US disclosed
US-20180323378-A9 HETEROCYCLIC COMPOUNDS AND THEIR USE IN ELECTRO-OPTICAL OR OPTO-ELECTRONIC DEVICES POWER OLEDS LIMITED (GB) 2018-11-08 — — US disclosed
EP-2232611-B1 BARRIER COATED SUBSTRATE AND ELECTRO-OPTICAL DEVICE MERCK PATENT GMBH (DE) 2017-11-01 — — EP disclosed
US-9437828-B2 Electroluminescent device using azomethine-lithium-complex as electron injection layer MERCK PATENT GMBH (DE) 2016-09-06 — — US disclosed
EP-2984079-A2 HETEROCYCLIC COMPOUNDS AND THEIR USE IN ELECTRO-OPTICAL OR OPTO-ELECTRONIC DEVICES Power Oleds Limited (GB) 2016-02-17 — — EP disclosed
US-20160035983-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE IN ELECTRO-OPTICAL OR OPTO-ELECTRONIC DEVICES POWER OLEDS LTD (GB) 2016-02-04 — — US disclosed
US-9221770-B2 Compounds having electron transport properties, their preparation and use MERCK PATENT GMBH (DE) 2015-12-29 — — US disclosed
US-20090167158-A1 Electroluminescent Devices MERCK PATENT GMBH (DE) 2009-07-02 — — US disclosed
WO-2008081178-A1 ELECTROLUMINESCENT DEVICE USING AZOMETHINE-LITHIUM-COMPLEX AS ELECTRON INJECTION LAYER MERCK PATENT GMBH (DE) 2008-07-10 — — WO disclosed
WO-2008078114-A1 ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2008-07-03 — — WO disclosed
WO-2008078115-A1 PHENANTHROLINE COMPOUNDS AND ELECTROLUMINESCENT DEVICES USING THE SAME MERCK PATENT GMBH (DE) 2008-07-03 — — WO disclosed
US-20080113215-A1 Electroluminescent Materials and Devices MERCK PATENT GMBH (DE) 2008-05-15 — — US disclosed
US-20070252108-A1 Electroluminescent Materials and Devices MERCK PATENT GMBH (DE) 2007-11-01 — — US disclosed
EP-1786885-A1 ELECTROLUMINESCENT MATERIALS AND DEVICES OLED-T LIMITED (GB) 2007-05-23 — — EP disclosed
WO-2006090098-A1 ELECTROLUMINESCENT MATERIALS AND DEVICES OLED-T LIMITED (GB) 2006-08-31 — — WO disclosed
WO-2006016176-A1 ELECTROLUMINESCENT MATERIALS AND DEVICES OLED-T LIMITED (GB) 2006-02-16 — — WO disclosed

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

For each of this compound's patents that has machine-readable text (5 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-20180323378-A9 HETEROCYCLIC COMPOUNDS AND THEIR USE IN ELECTRO-OPTICAL OR OPTO-ELECTRONIC DEVICES NAT1, SLCO2A1, SLCO2B1 GAA 4637/4885TAAR1 90/4885TP53 3900/4885
US-20070252108-A1 Electroluminescent Materials and Devices AAAS, ANXA1, ANXA2 GAA 1466/4885TAAR1 913/4885TP53 1666/4885
US-10439147-B2 Heterocyclic compounds and their use in electro-optical or opto-electronic devices NAT1, SLCO2A1, SLCO2B1 GAA 4637/4885TAAR1 90/4885TP53 3900/4885
US-20080113215-A1 Electroluminescent Materials and Devices AAAS, ACMSD, KCNH1 GAA 2172/4885TAAR1 646/4885TP53 903/4885
US-20160035983-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE IN ELECTRO-OPTICAL OR OPTO-ELECTRONIC DEVICES NAT1, SLCO2A1, SLCO2B1 GAA 4637/4885TAAR1 90/4885TP53 3900/4885

“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.