SCHEMBL2082932

SCHEMBL2082932

Clc1ccc(-c2c3ccccc3cc3ccccc23)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.55
GPR84 Q9NQS5 1/20 0.51
CYP1A2 P05177 5/20 0.46
ESR1 P03372 3/20 0.45
ESR2 Q92731 3/20 0.45
KDM4E B2RXH2 3/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
MAPT P10636 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 0.44
CYP2C19 P33261 1/20 0.44
CASP3 P42574 1/20 0.44
RAB9A P51151 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43

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
SCHEMBL25770808 0.89 ALOX5 (0.46) ALOX5GPR84CYP1A2ESR1ESR2
SCHEMBL13433266 0.84 ALOX5 (0.52) ALOX5GPR84CYP1A2ESR1ESR2
SCHEMBL15763549 0.84 ESR1 (0.51) ALOX5GPR84ESR1ESR2KDM4E
SCHEMBL15763542 0.84 ESR1 (0.55) ALOX5GPR84CYP1A2ESR1ESR2
SCHEMBL6123650 0.84 CYP1A2 (0.57) GPR84CYP1A2ESR1ESR2KDM4E
SCHEMBL5947997 0.84 CYP1A2 (0.57) GPR84CYP1A2ESR1ESR2KDM4E
SCHEMBL2701765 0.82 GPR84 (0.43) ALOX5GPR84CYP1A2ESR1ESR2
SCHEMBL2709851 0.82 ALOX5 (0.59) ALOX5GPR84CYP1A2ESR1ESR2
SCHEMBL29591632 0.82 ALOX5 (0.59) ALOX5GPR84CYP1A2ESR1ESR2
SCHEMBL27953244 0.82 ESR1 (0.57) GPR84CYP1A2ESR1ESR2KDM4E

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021141428-A1 BISANTHRACENE DERIVATIVES HAVING SOLUBILIZING SUBSTITUENT, AND ORGANIC ELECTROLUMINESCENCE DEVICE USING SAME 주식회사 엘지화학 2021-07-15 WO disclosed
CN-107216229-A A kind of method of chromic salts/methyl-magnesium-bromide selective catalytic hydrogenation polycyclic aromatic hydrocarbon 四川大学 2017-09-29 CN disclosed
US-8173273-B2 Anthracene derivatives, method for preparation thereof, and organic electronic device using the same LG CHEM, LTD. (KR) 2012-05-08 US disclosed
US-8173273-B2 Anthracene derivatives, method for preparation thereof, and organic electronic device using the same LG CHEM, LTD. (KR) 2012-05-08 US disclosed
US-20110049482-A1 Novel aromatic compound and organic electroluminescent element containing the same IDEMITSU KOSAN CO., LTD. (JP) 2011-03-03 US disclosed
US-7790892-B2 Aromatic compound and organic electroluminescent element containing the same IDEMITSU KOSAN CO., LTD. (JP) 2010-09-07 US disclosed
US-20100044681-A1 Novel Anthracene Derivatives, Method for Preparation Thereof, and Organic Electronic Device Using the Same LG CHEM, LTD. (KR) 2010-02-25 US disclosed
US-20100044681-A1 Novel Anthracene Derivatives, Method for Preparation Thereof, and Organic Electronic Device Using the Same LG CHEM, LTD. (KR) 2010-02-25 US disclosed
CN-100475759-C Novel aromatic compound and organic electroluminescent element containing the same IDEMITSU PETROCHEMICAL CO (JP) 2009-04-08 CN disclosed
WO-2007123339-A9 NOVEL ANTHRACENE DERIVATIVES, METHOD FOR PREPARATION THEREOF, AND ORGANIC ELECTRONIC DEVICE USING THE SAME LG CHEMICAL LTD (KR) 2008-12-11 WO disclosed
WO-2007123339-A1 NOVEL ANTHRACENE DERIVATIVES, METHOD FOR PREPARATION THEREOF, AND ORGANIC ELECTRONIC DEVICE USING THE SAME LG CHEM, LTD. (KR) 2007-11-01 WO disclosed
CN-1939884-A Novel aromatic compound and organic electroluminescent element containing the same IDEMITSU KOSAN CO (JP) 2007-04-04 CN disclosed
CN-1876610-A Novel aromatic compound and organic electroluminescent element containing the same IDEMITSU KOSAN CO (JP) 2006-12-13 CN disclosed
US-20050214565-A1 Novel aromatic compound and organic electroluminescent element containing the same IDEMITSU KOSAN CO., LTD. (JP) 2005-09-29 US disclosed
CN-1646456-A Novel aromatic compound and organic electroluminescent element containing the same IDEMITSU KOSAN CO (JP) 2005-07-27 CN disclosed
EP-1496041-A1 NOVEL AROMATIC COMPOUND AND ORGANIC ELECTROLUMINESCNET ELEMENT CONTAINING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2005-01-12 EP 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 (2 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-20100044681-A1 Novel Anthracene Derivatives, Method for Preparation Thereof, and Organic Electronic Device Using the Same XPOT, TOMM22, TIMM10 ALOX5 361/4885GPR84 3907/4885CYP1A2 71/4885
US-20110049482-A1 Novel aromatic compound and organic electroluminescent element containing the same TYR, EML4, TCF7L2 ALOX5 3307/4885GPR84 3527/4885CYP1A2 644/4885

“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.