SCHEMBL2458795

SCHEMBL2458795

C=C=C(C)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.42
CES1 P23141 3/20 0.42
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
ALDH1A1 P00352 3/20 0.38
TSHR P16473 2/20 0.38
DAO P14920 1/20 0.38
NAPRT Q6XQN6 1/20 0.38
MAPT P10636 3/20 0.37
ESR1 P03372 1/20 0.37
AKT1 P31749 1/20 0.36
LMNA P02545 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
XBP1 P17861 1/20 0.35
ATM Q13315 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL28432141 0.86 SMN1; SMN2 (0.54) ALDH1A1MAPTL3MBTL1SMN1; SMN2
SCHEMBL28126867 0.76 CES2 (0.44) CES2CES1ALDH1A1TSHRDAO
SCHEMBL3846147 0.76 CES2 (0.44) CES2CES1ALDH1A1TSHRDAO
SCHEMBL9194201 0.76 CES2 (0.44) CES2CES1ALDH1A1TSHRDAO
SCHEMBL701017 0.76 CES2 (0.44) CES2CES1ALDH1A1TSHRDAO
SCHEMBL8234469 0.75 CYP19A1 (0.48) MAOAALDH1A1TSHRMAPTESR1
SCHEMBL5828005 0.74 CES1 (0.48) CES2CES1ALDH1A1TSHRDAO
SCHEMBL15656328 0.74 CES2 (0.42) CES2CES1ALDH1A1TSHRDAO
SCHEMBL28170573 0.74 CES2 (0.42) CES2CES1ALDH1A1TSHRDAO
SCHEMBL28835292 0.74 CES2 (0.42) CES2CES1MAOAMAOBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10920004-B2 Method for preparing modified conjugated diene-based polymer LG CHEM, LTD. 2021-02-16 US claimed
US-10882939-B2 2021-01-05 US claimed
US-20190256635-A1 Method for Preparing Modified Conjugated Diene-based Polymer LG CHEM, LTD. (KR) 2019-08-22 US claimed
EP-3473654-B1 METHOD FOR PREPARING MODIFIED CONJUGATED DIENE-BASED POLYMER, AND MODIFIED CONJUGATED DIENE-BASED POLYMER PREPARED BY USING SAME LG CHEMICAL LTD (KR) 2022-04-20 EP disclosed
EP-3792291-B1 METHOD FOR PREPARING MODIFIED CONJUGATED DIENE-BASED POLYMER LG CHEMICAL LTD (KR) 2022-03-16 EP disclosed
EP-3792291-A1 METHOD FOR PREPARING MODIFIED CONJUGATED DIENE-BASED POLYMER LG CHEM, LTD. (KR) 2021-03-17 EP disclosed
CN-112480835-A Adhesive sheet 日本电石工业株式会社 2021-03-12 CN disclosed
US-10920004-B2 Method for preparing modified conjugated diene-based polymer LG CHEM, LTD. 2021-02-16 US disclosed
EP-3511350-B1 METHOD FOR PREPARING MODIFIED CONJUGATED DIENE-BASED POLYMER LG CHEMICAL LTD (KR) 2021-01-27 EP disclosed
US-10882939-B2 2021-01-05 US disclosed
CN-209496895-U The encapsulating structure and light source of composite fluorescence glue film, semiconductor light-emitting apparatus 弗洛里光电材料(苏州)有限公司 2019-10-15 CN disclosed
US-20100277063-A1 FLUORENE-BASED DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2010-11-04 US disclosed
US-7781628-B2 Fluorene-based derivative and organic electroluminescence device employing the same IDEMITSU KOSAN CO., LTD. (JP) 2010-08-24 US disclosed
US-20100210661-A1 STAT3/5 ACTIVATION INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-08-19 US disclosed
US-7683225-B2 Fluorene-based derivative and organic electroluminescence device employing the same IDEMITSU KOSAN CO., LTD. (JP) 2010-03-23 US disclosed
US-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-01-07 US disclosed
US-20080303433-A1 FLUORENE-BASED DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2008-12-11 US disclosed
US-20070270422-A1 Aromatic Compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-11-22 US disclosed
EP-1780191-A1 FLUORENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-05-02 EP disclosed
US-20060159956-A1 Fluorene-based derivative and organic electroluminescence device employing the same IDEMITSU KOSAN CO., LTD. (JP) 2006-07-20 US 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-20100277063-A1 FLUORENE-BASED DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME LEF1, FLNA, AFF2 CES2 330/4885CES1 2129/4885MAOA 83/4885
US-20080303433-A1 FLUORENE-BASED DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME FLNA, AFF2, LEF1 CES2 491/4885CES1 2433/4885MAOA 105/4885
US-20100210661-A1 STAT3/5 ACTIVATION INHIBITOR STAT3, JAK2, STAT1 CES2 3247/4885CES1 2557/4885MAOA 3260/4885
US-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS ROS1, CBR1, CBR3 CES2 2426/4885CES1 447/4885MAOA 3148/4885
US-20070270422-A1 Aromatic Compounds COL1A1, COL2A1, COL14A1 CES2 1853/4885CES1 921/4885MAOA 317/4885

“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.