SCHEMBL16620334

SCHEMBL16620334

Cc1ccccc1N=C1CCCC(C#N)C1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD11B1 P28845 1/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 2/20 0.31
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PAX8 Q06710 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL16620333 1.00 ALDH1A1 (0.33) ALDH1A1MEN1GAAKMT2AHSD11B1
SCHEMBL16620210 0.91 ALDH1A1 (0.35) ALDH1A1MEN1GAAKMT2AHSD11B1
SCHEMBL16620211 0.91 ALDH1A1 (0.35) ALDH1A1MEN1GAAKMT2AHSD11B1
SCHEMBL16620306 0.82 USP2 (0.35) ALDH1A1MEN1GAAKMT2AHSD11B1
SCHEMBL17985151 0.79 ALDH1A1 (0.33) ALDH1A1TP53KDM4EMAPTMAPK1
SCHEMBL17985152 0.79 ALDH1A1 (0.33) ALDH1A1TP53KDM4EMAPTMAPK1
SCHEMBL8743917 0.79 POLB (0.46) ALDH1A1MEN1GAAKMT2AUSP2
SCHEMBL8743920 0.79 POLB (0.46) ALDH1A1MEN1GAAKMT2AUSP2
SCHEMBL16620215 0.77 MAOB (0.30)
SCHEMBL16620217 0.77 MAOB (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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