SCHEMBL5317255

SCHEMBL5317255

O=C(c1ccccc1)c1cccc(Sc2ccccc2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
ALDH1A1 P00352 3/20 0.56
PBRM1 Q86U86 1/20 0.55
HPGD P15428 3/20 0.52
HSD17B10 Q99714 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C9 P11712 1/20 0.52
SRD5A2 P31213 1/20 0.48
PTGS1 P23219 3/20 0.47
PTGS2 P35354 3/20 0.47
MAPT P10636 2/20 0.47
CXCR1 P25024 2/20 0.47
CXCR2 P25025 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
RECQL P46063 1/20 0.47
KDM4E B2RXH2 1/20 0.47
LMNA P02545 1/20 0.47
CYP3A4 P08684 1/20 0.47

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
SCHEMBL29363502 1.00 ATM (0.65) ATMTDP1L3MBTL1ALDH1A1PBRM1
SCHEMBL9624909 0.96 ATM (0.61) ATMTDP1L3MBTL1ALDH1A1PBRM1
Benzophenone SCHEMBL8749969 0.89 ALDH1A1 (0.70) ATMTDP1L3MBTL1ALDH1A1PBRM1
SCHEMBL6778027 0.86 HPGD (0.70) ALDH1A1HPGDHSD17B10CYP1A2CYP2C9
SCHEMBL21506865 0.85 ALDH1A1 (0.67) ATMTDP1L3MBTL1ALDH1A1HPGD
SCHEMBL385623 0.85 ALDH1A1 (0.67) ATMTDP1L3MBTL1ALDH1A1HPGD
SCHEMBL11593124 0.84 CES2 (0.56) ATMTDP1L3MBTL1ALDH1A1HPGD
SCHEMBL3282737 0.83 HPGD (0.69) ATMTDP1L3MBTL1ALDH1A1HPGD
SCHEMBL6787662 0.83 ALDH1A1 (0.67) ATMTDP1L3MBTL1ALDH1A1HPGD
SCHEMBL17828245 0.83 ALDH1A1 (0.67) ATMTDP1L3MBTL1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114402260-A Photoacid generators 三亚普罗股份有限公司 2022-04-26 CN disclosed
WO-2007064869-A2 CATALYSTS FOR ARYL SULFIDE SYNTHESIS AND METHOD OF PRODUCING ARYL SULFIDES YALE UNIVERSITY (US) 2007-06-07 WO disclosed
WO-2007064869-A2 CATALYSTS FOR ARYL SULFIDE SYNTHESIS AND METHOD OF PRODUCING ARYL SULFIDES YALE UNIVERSITY (US) 2007-06-07 WO disclosed
EP-0279217-B1 PROCESS FOR THE PREPARATION OF POLY(ARYLENSULFIDES) WITH ADJUSTABLE MELT VISCOSITY BAYER AG (DE) 1992-03-11 EP disclosed