SCHEMBL16620468

SCHEMBL16620468

Cc1ccc(N=C2CCC(C#N)C2)cc1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
CYP2A6 P11509 1/20 0.31
HPGD P15428 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 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
SCHEMBL16620467 1.00 ALDH1A1 (0.31) ALDH1A1CYP2A6HPGDCYP1A2CYP11B1
SCHEMBL16620215 0.91 MAOB (0.30)
SCHEMBL16620217 0.91 MAOB (0.30)
SCHEMBL16620443 0.90 ALDH1A1 (0.32) ALDH1A1CYP2A6HPGD
SCHEMBL17985131 0.83 CYP1A2 (0.34) CYP1A2CYP11B1CYP11B2
SCHEMBL17985128 0.83 CYP1A2 (0.34) CYP1A2CYP11B1CYP11B2
SCHEMBL16621217 0.82 SMN1; SMN2 (0.36) ALDH1A1HPGDCYP1A2CYP11B1CYP11B2
SCHEMBL16621218 0.82 SMN1; SMN2 (0.36) ALDH1A1HPGDCYP1A2CYP11B1CYP11B2
SCHEMBL16620210 0.75 ALDH1A1 (0.35) ALDH1A1CYP1A2CYP11B1CYP11B2
SCHEMBL16620211 0.75 ALDH1A1 (0.35) ALDH1A1CYP1A2CYP11B1CYP11B2

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