SCHEMBL9101241

SCHEMBL9101241

CCCc1ccc(C(=O)c2cccc(N)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.62
NPC1 O15118 3/20 0.58
POLB P06746 3/20 0.58
MITF O75030 1/20 0.58
LMNA P02545 1/20 0.58
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA9 Q16790 1/20 0.51
THRB P10828 1/20 0.49
CNR2 P34972 1/20 0.48
GAA P10253 3/20 0.47
PLK1 P53350 1/20 0.46
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
RAB9A P51151 2/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
ATM Q13315 1/20 0.43
TDP1 Q9NUW8 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
SCHEMBL11865541 0.87 PBRM1 (0.66) PBRM1NPC1POLBMITFLMNA
SCHEMBL9719372 0.83 PBRM1 (0.70) PBRM1NPC1POLBMITFLMNA
SCHEMBL9099918 0.83 PLK1 (0.55) NPC1POLBLMNACA2THRB
SCHEMBL9097509 0.83 PBRM1 (0.88) PBRM1NPC1POLBMITFLMNA
SCHEMBL203373 0.83 PBRM1 (0.88) PBRM1NPC1POLBMITFLMNA
SCHEMBL29492473 0.83 PBRM1 (0.88) PBRM1NPC1POLBMITFLMNA
SCHEMBL21887389 0.83 L3MBTL1 (0.53) CA1CA2CA9CNR2GAA
Benzophenone SCHEMBL28417175 0.81 L3MBTL1 (0.58) NPC1POLBLMNATHRBCNR2
SCHEMBL4605419 0.81 L3MBTL1 (0.58) NPC1POLBLMNATHRBCNR2
SCHEMBL8079282 0.81 GAA (0.50) NPC1LMNATHRBCNR2GAA

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-5510425-A AROMATIC POLYIMIDE-EPOXY COPOLYMER MODIFIED BY BISMALEIMIDE COMPOUND; FLEXIBILITY, PEELING STRENGTH; COLDSETTING RESINS, ADHESIVES HITACHI CHEMICAL COMPANY, LTD. (JP) 1996-04-23 US disclosed