SCHEMBL9624909

SCHEMBL9624909

O=C(c1ccccc1)c1ccc(Sc2cccc(C(=O)c3ccccc3)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
ALDH1A1 P00352 3/20 0.56
HPGD P15428 3/20 0.56
PBRM1 Q86U86 1/20 0.52
SRD5A2 P31213 1/20 0.50
HSD17B10 Q99714 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
MEN1 O00255 2/20 0.47
RAB9A P51151 2/20 0.47
KMT2A Q03164 2/20 0.47
NPC1 O15118 1/20 0.47
MAPT P10636 3/20 0.45
PTGS1 P23219 3/20 0.45
PTGS2 P35354 3/20 0.45
CXCR1 P25024 2/20 0.45
CXCR2 P25025 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45

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 0.96 ATM (0.65) ATMTDP1L3MBTL1ALDH1A1HPGD
SCHEMBL5317255 0.96 ATM (0.65) ATMTDP1L3MBTL1ALDH1A1HPGD
SCHEMBL21506865 0.90 ALDH1A1 (0.67) ATMTDP1L3MBTL1ALDH1A1HPGD
SCHEMBL385623 0.90 ALDH1A1 (0.67) ATMTDP1L3MBTL1ALDH1A1HPGD
SCHEMBL3282737 0.88 HPGD (0.69) ATMTDP1L3MBTL1ALDH1A1HPGD
SCHEMBL6787662 0.88 ALDH1A1 (0.67) ATMTDP1L3MBTL1ALDH1A1HPGD
SCHEMBL17828242 0.88 ALDH1A1 (0.67) ATMTDP1L3MBTL1ALDH1A1HPGD
SCHEMBL17828245 0.88 ALDH1A1 (0.67) ATMTDP1L3MBTL1ALDH1A1HPGD
SCHEMBL7705896 0.86 HPGD (0.50) ATMTDP1L3MBTL1ALDH1A1HPGD
Benzophenone SCHEMBL8749969 0.86 ALDH1A1 (0.70) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0279217-B1 PROCESS FOR THE PREPARATION OF POLY(ARYLENSULFIDES) WITH ADJUSTABLE MELT VISCOSITY BAYER AG (DE) 1992-03-11 EP disclosed