SCHEMBL16620665

SCHEMBL16620665

Cc1cccc(/N=C/c2ccc(C#N)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.46
KDM4E B2RXH2 6/20 0.46
LMNA P02545 3/20 0.46
GAA P10253 2/20 0.46
KMT2A Q03164 7/20 0.44
MEN1 O00255 6/20 0.44
MAPT P10636 6/20 0.44
TDP1 Q9NUW8 1/20 0.44
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CYP2A6 P11509 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
PLA2G1B P04054 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
MAPK1 P28482 1/20 0.41
IDO1 P14902 1/20 0.40
NPC1 O15118 1/20 0.40
CASP3 P42574 1/20 0.40

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
SCHEMBL16620667 1.00 ALDH1A1 (0.46) ALDH1A1KDM4ELMNAGAAKMT2A
SCHEMBL16620621 0.86 GRIN2D (0.49) ALDH1A1KDM4ELMNAKMT2AMEN1
SCHEMBL16620623 0.86 GRIN2D (0.49) ALDH1A1KDM4ELMNAKMT2AMEN1
SCHEMBL16621184 0.84 NPC1 (0.51) ALDH1A1KDM4ELMNAGAAKMT2A
SCHEMBL16621183 0.84 NPC1 (0.51) ALDH1A1KDM4ELMNAGAAKMT2A
SCHEMBL16620013 0.84 ALDH1A1 (0.48) ALDH1A1KDM4ELMNAGAAKMT2A
SCHEMBL16620014 0.84 ALDH1A1 (0.48) ALDH1A1KDM4ELMNAGAAKMT2A
SCHEMBL16620167 0.83 NPC1 (0.50) ALDH1A1KDM4ELMNAKMT2AMEN1
SCHEMBL16620166 0.83 NPC1 (0.50) ALDH1A1KDM4ELMNAKMT2AMEN1
SCHEMBL14832086 0.81 CYP1A2 (0.52) ALDH1A1KDM4ELMNAGAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3052531-B1 POLYMERS FUNCTIONALIZED WITH IMINE COMPOUNDS CONTAINING A CYANO GROUP BRIDGESTONE CORP (JP) 2024-07-24 EP disclosed
US-11066486-B2 Polymers functionalized with imine compounds containing a cyano group BRIDGESTONE CORPORATION (JP) 2021-07-20 US disclosed
US-20200157253-A1 POLYMERS FUNCTIONALIZED WITH IMINE COMPOUNDS CONTAINING A CYANO GROUP BRIDGESTONE CORPORATION (JP) 2020-05-21 US disclosed
US-10590208-B2 Polymers functionalized with imine compounds containing a cyano group BRIDGESTONE CORPORATION (JP) 2020-03-17 US disclosed
US-20160237179-A1 Polymers Functionalized With Imine Compounds Containing A Cyano Group BRIDGESTONE CORPORATION (JP) 2016-08-18 US disclosed
EP-3052531-A1 POLYMERS FUNCTIONALIZED WITH IMINE COMPOUNDS CONTAINING A CYANO GROUP Bridgestone Corporation (JP) 2016-08-10 EP disclosed
WO-2015050947-A1 POLYMERS FUNCTIONALIZED WITH IMINE COMPOUNDS CONTAINING A CYANO GROUP BRIDGESTONE CORPORATION (JP) 2015-04-09 WO disclosed