SCHEMBL17499723

SCHEMBL17499723

COc1ccccc1/N=C/c1ccnn1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.46
KDM4E B2RXH2 5/20 0.46
HSD17B10 Q99714 2/20 0.46
CASP1 P29466 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
HPGD P15428 4/20 0.41
NPSR1 Q6W5P4 2/20 0.41
SENP7 Q9BQF6 1/20 0.41
MAPT P10636 7/20 0.40
HIF1A Q16665 2/20 0.40
STAT6 P42226 1/20 0.38
UBE2N P61088 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
NSD2 O96028 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
SCHEMBL17499727 1.00 ALDH1A1 (0.46) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL17499173 0.87 KMT2A (0.35) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL17499169 0.87 KMT2A (0.35) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL17499502 0.76 GRIN1 (0.40) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL16100418 0.76 ALDH1A1 (0.38) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL17499503 0.76 GRIN1 (0.40) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL16101693 0.76 SMN1; SMN2 (0.36) ALDH1A1KDM4EHSD17B10MEN1KMT2A
SCHEMBL17499770 0.75 ALDH1A1 (0.45) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL17499768 0.75 ALDH1A1 (0.45) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL17499507 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