SCHEMBL8443302

SCHEMBL8443302

S=[C]c1ccc(-c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.52
CYP1A1 P04798 1/20 0.52
CYP1B1 Q16678 1/20 0.52
ALDH1A1 P00352 2/20 0.50
TAAR1 Q96RJ0 2/20 0.43
MAPK1 P28482 1/20 0.43
CYP3A4 P08684 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MMP3 P08254 1/20 0.43
BCL2L1 Q07817 1/20 0.43
KCNH2 Q12809 1/20 0.42
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
MGLL Q99685 1/20 0.39
KIF11 P52732 1/20 0.39
NOTUM Q6P988 1/20 0.38
ALOX5 P09917 1/20 0.37
APP P05067 1/20 0.36
GABRA1 P14867 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
SCHEMBL5989645 0.82 CYP1A2 (0.56) CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1
SCHEMBL8163 0.82
SCHEMBL10863333 0.78 APP (0.32) APP
SCHEMBL827097 0.74 ALDH1A1 (0.90) CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1
SCHEMBL18674172 0.74 ALDH1A1 (0.90) CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1
Biphenyl SCHEMBL895675 0.74 ALDH1A1 (0.90) CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1
SCHEMBL1991754 0.74 ALDH1A1 (0.90) CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1
SCHEMBL143471 0.74 ALDH1A1 (0.90) CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1
SCHEMBL2637802 0.74 ALDH1A1 (0.90) CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1
Tannin Pyrogallol SCHEMBL21448 0.74 ALDH1A1 (0.90) CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5919403-A POLYESTERS EASTMAN CHEMICAL COMPANY (US) 1999-07-06 US claimed
CN-1209146-A Polymeric fluorescence quenching compounds and their use EASTMAN CHEM CO (US) 1999-02-24 CN claimed
EP-0868465-A1 POLYMERIC FLUORESCENCE QUENCHING COMPOUNDS AND THEIR USE EASTMAN CHEMICAL COMPANY (US) 1998-10-07 EP claimed
WO-1997023540-A1 POLYMERIC FLUORESCENCE QUENCHING COMPOUNDS AND THEIR USE EASTMAN CHEMICAL COMPANY (US) 1997-07-03 WO claimed
EP-2478981-B1 SILVER-(CONJUGATED COMPOUND) COMPLEX SUMITOMO CHEMICAL CO (JP) 2020-12-23 EP disclosed
US-9704612-B2 Composition of silver-conjugated compound composite SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-07-11 US disclosed
US-9412487-B2 Silver-(conjugated compound) composite SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-09 US disclosed
CN-102300925-B Curable composition CEMEDINE CO LTD 2014-06-18 CN disclosed
US-20140001422-A1 COMPOSITION OF SILVER-CONJUGATED COMPOUND COMPOSITE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-02 US disclosed
EP-2478981-A1 SILVER-(CONJUGATED COMPOUND) COMPLEX Sumitomo Chemical Co., Ltd (JP) 2012-07-25 EP disclosed
US-20120168693-A1 SILVER-(CONJUGATED COMPOUND) COMPOSITE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-05 US disclosed
CN-102300925-A Curable composition 2011-12-28 CN disclosed
CN-1209146-A Polymeric fluorescence quenching compounds and their use EASTMAN CHEM CO (US) 1999-02-24 CN disclosed
CN-1209150-A Polyester blend compositions containing naphthalene dicarboxylate having reduced fluorescence EASTMAN CHEM CO (US) 1999-02-24 CN disclosed
EP-0868488-A1 NAPHTHALENEDICARBOXYLATE CONTAINING POLYESTER BLEND COMPOSITIONS HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1998-10-07 EP disclosed
EP-0868465-A1 POLYMERIC FLUORESCENCE QUENCHING COMPOUNDS AND THEIR USE EASTMAN CHEMICAL COMPANY (US) 1998-10-07 EP disclosed
US-5705600-A MELT BLENDING A POLYESTER AND POLYAMIDE WITH FLUORESCENCE QUENCHING COMPOUND EASTMAN CHEMICAL COMPANY (US) 1998-01-06 US disclosed
WO-1997023540-A1 POLYMERIC FLUORESCENCE QUENCHING COMPOUNDS AND THEIR USE EASTMAN CHEMICAL COMPANY (US) 1997-07-03 WO disclosed
WO-1997023568-A1 NAPHTHALENEDICARBOXYLATE CONTAINING POLYESTER BLEND COMPOSITIONS HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1997-07-03 WO disclosed
WO-1997023569-A1 POLYESTER/NAPHTHALENEDICARBOXYLIC ACID-CONTAINING POLYMER BLENDS DISPLAYING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1997-07-03 WO disclosed