SCHEMBL7705896

SCHEMBL7705896

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

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.50
ALDH1A1 P00352 2/20 0.50
MGLL Q99685 2/20 0.49
PGR P06401 1/20 0.49
ATM Q13315 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MEN1 O00255 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
POLB P06746 1/20 0.47
SRD5A2 P31213 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SERPINE1 P05121 1/20 0.43
MAOB P27338 1/20 0.43
PARP1 P09874 1/20 0.43
ALOX15 P16050 2/20 0.43
CNR1 P21554 1/20 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
SCHEMBL29366595 0.88 PARP1 (0.52) HPGDALDH1A1MGLLPGRATM
SCHEMBL692675 0.87 CSNK2A2 (0.49) HPGDALDH1A1MGLLMEN1GAA
SCHEMBL9624909 0.86 ATM (0.61) HPGDALDH1A1ATMTDP1L3MBTL1
SCHEMBL8771928 0.84 SRD5A2 (0.59) HPGDALDH1A1L3MBTL1MAPTPOLB
SCHEMBL21506865 0.84 ALDH1A1 (0.67) HPGDALDH1A1ATMTDP1L3MBTL1
SCHEMBL385623 0.84 ALDH1A1 (0.67) HPGDALDH1A1ATMTDP1L3MBTL1
SCHEMBL5317255 0.83 ATM (0.65) HPGDALDH1A1ATMTDP1L3MBTL1
SCHEMBL29363502 0.83 ATM (0.65) HPGDALDH1A1ATMTDP1L3MBTL1
SCHEMBL17828242 0.82 ALDH1A1 (0.67) HPGDALDH1A1ATMTDP1L3MBTL1
SCHEMBL6787662 0.82 ALDH1A1 (0.67) HPGDALDH1A1ATMTDP1L3MBTL1

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
US-6368769-B1 PHOTOPOLYMERIZATION ASAHI DENKI KOGYO KABUSHIKI KAISHA (JP) 2002-04-09 US disclosed