SCHEMBL17499208

SCHEMBL17499208

COc1ccccc1/N=C/c1ccn(C)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.46
KDM4E B2RXH2 6/20 0.46
HSD17B10 Q99714 2/20 0.46
CASP1 P29466 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
KMT2A Q03164 7/20 0.39
MEN1 O00255 6/20 0.39
HPGD P15428 4/20 0.39
NPSR1 Q6W5P4 2/20 0.39
SENP7 Q9BQF6 1/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 6/20 0.38
HIF1A Q16665 2/20 0.38
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
STAT6 P42226 1/20 0.36
AMY1A P0DUB6 1/20 0.35
PABPC1 P11940 1/20 0.35
TSHR P16473 1/20 0.35
CA12 O43570 1/20 0.34

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
SCHEMBL17499210 1.00 ALDH1A1 (0.46) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL17499447 0.86 ALDH1A1 (0.34) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL17499445 0.86 ALDH1A1 (0.34) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL16101547 0.76 KMT2A (0.34) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL16101493 0.76 ALDH1A1 (0.38) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL17499399 0.76 GRIN1 (0.40) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL17499402 0.76 GRIN1 (0.40) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL17499679 0.75 ALDH1A1 (0.45) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL17499676 0.75 ALDH1A1 (0.45) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL16101460 0.74 ALDH1A1 (0.44) ALDH1A1KDM4EHSD17B10CASP1RXFP1

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 3 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