SCHEMBL11075432

SCHEMBL11075432

COc1ccc(-c2nc3c4ccccc4ccc3n2C)cc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHMT2 P34897 1/20 0.48
MAPT P10636 3/20 0.42
KDM4E B2RXH2 4/20 0.41
TLR7 Q9NYK1 1/20 0.41
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HSD17B10 Q99714 2/20 0.39
PARP1 P09874 1/20 0.39
RECQL P46063 1/20 0.39
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL11448810 0.92 SHMT2 (0.48) SHMT2MAPTKDM4ENPC1RAB9A
SCHEMBL11443172 0.87 TLR7 (0.45) SHMT2MAPTKDM4ETLR7NPC1
SCHEMBL11073152 0.84 HSD17B10 (0.44) MAPTKDM4ENPC1RAB9AMEN1
SCHEMBL11073129 0.83 PARP1 (0.55) MAPTKDM4ETLR7NPC1RAB9A
SCHEMBL11182201 0.82 PSEN1 (0.45) MAPTKDM4ETLR7MEN1KMT2A
SCHEMBL11081006 0.81 TLR7 (0.40) SHMT2MAPTKDM4ETLR7NPC1
SCHEMBL11190730 0.80 KMT2A (0.45) MAPTKDM4ERAB9AMEN1KMT2A
SCHEMBL11440934 0.80 TLR7 (0.49) MAPTTLR7NPC1RAB9AMEN1
SCHEMBL11184964 0.79 TLR7 (0.51) MAPTKDM4ETLR7NPC1RAB9A
SCHEMBL11190739 0.79 TLR7 (0.43) MAPTKDM4ETLR7NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4435417-A ANTIINFLAMMATORY AGENTS GRUPPO LEPETIT S.P.A. (IT) 1984-03-06 US disclosed
EP-0012866-B1 NEW 3H-NAPHTHO(1,2-D)IMIDAZOLES, PROCESSES FOR PREPARING THEM, COMPOUNDS FOR USE AS ANTIINFLAMMATORY AND ANTIMICROBIAL AGENTS AND COMPOSITIONS FOR THAT USE CONTAINING THEM GRUPPO LEPETIT S.P.A. (IT) 1983-01-19 EP disclosed