SCHEMBL16096586

SCHEMBL16096586

COc1ccccc1/N=C\c1ccc(C)cn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.42
KDM4E B2RXH2 6/20 0.42
POLB P06746 1/20 0.42
RXFP1 Q9HBX9 2/20 0.40
CASP1 P29466 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KMT2A Q03164 6/20 0.39
MEN1 O00255 5/20 0.39
HPGD P15428 5/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 8/20 0.38
HIF1A Q16665 2/20 0.38
TDP1 Q9NUW8 2/20 0.37
APOBEC3A P31941 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
STAT6 P42226 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
SCHEMBL16096588 1.00 ALDH1A1 (0.42) ALDH1A1KDM4EPOLBRXFP1CASP1
SCHEMBL17499431 0.86 ALDH1A1 (0.35) ALDH1A1KDM4EPOLBHSD17B10KMT2A
SCHEMBL17499433 0.86 ALDH1A1 (0.35) ALDH1A1KDM4EPOLBHSD17B10KMT2A
SCHEMBL17499334 0.85 ALDH1A1 (0.33) ALDH1A1KDM4EPOLBHSD17B10KMT2A
SCHEMBL16097837 0.82 ALDH1A1 (0.41) ALDH1A1KDM4EPOLBRXFP1CASP1
SCHEMBL17499465 0.82 ALDH1A1 (0.41) ALDH1A1KDM4EPOLBRXFP1CASP1
SCHEMBL16096158 0.82 ALDH1A1 (0.42) ALDH1A1KDM4EPOLBRXFP1CASP1
SCHEMBL16096160 0.82 ALDH1A1 (0.42) ALDH1A1KDM4EPOLBRXFP1CASP1
SCHEMBL16098068 0.80 NR4A1 (0.54) ALDH1A1KDM4EPOLBRXFP1CASP1
SCHEMBL16098070 0.80 NR4A1 (0.54) ALDH1A1KDM4EPOLBRXFP1CASP1

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