SCHEMBL16097247

SCHEMBL16097247

COc1ccccc1N=Cc1ccsc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.45
KDM4E B2RXH2 6/20 0.45
CASP1 P29466 1/20 0.45
HSD17B10 Q99714 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
HPGD P15428 4/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
SENP7 Q9BQF6 1/20 0.43
CYP1B1 Q16678 1/20 0.41
LMNA P02545 2/20 0.40
EGFR P00533 1/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 4/20 0.37
HIF1A Q16665 2/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36

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
SCHEMBL16097246 1.00 ALDH1A1 (0.45) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL17499599 0.84 LMNA (0.34) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL17499178 0.84 RAB9A (0.36) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL17499176 0.84 RAB9A (0.36) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL1643205 0.80 ALDH1A1 (0.48) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL1643202 0.80 ALDH1A1 (0.48) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL28610776 0.80 ALDH1A1 (0.48) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL3272348 0.76 GAA (0.57) ALDH1A1KDM4ECASP1HSD17B10RXFP1
SCHEMBL16096812 0.75 GRIN1 (0.45) ALDH1A1HPGDMEN1KMT2ALMNA
SCHEMBL16096811 0.75 GRIN1 (0.45) ALDH1A1HPGDMEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2969593-B1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORP (JP) 2020-11-04 EP disclosed
US-9850328-B2 Polymers functionalized with heterocyclic imines BRIDGESTONE CORPORATION (JP) 2017-12-26 US disclosed
US-20160039958-A1 Polymers Functionalized With Heterocyclic Imines BRIDGESTONE CORPORATION (JP) 2016-02-11 US disclosed
EP-2969593-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES Bridgestone Corporation (JP) 2016-01-20 EP disclosed
WO-2014149931-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORPORATION (JP) 2014-09-25 WO disclosed