SCHEMBL16620055

SCHEMBL16620055

Cc1ccc(/N=C2\CCCC2C#N)cc1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.32
ALDH1A1 P00352 2/20 0.31
CYP2A6 P11509 1/20 0.31
HPGD P15428 1/20 0.30
PDE9A O76083 1/20 0.30
GAA P10253 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
SCHEMBL16620058 1.00 DPP4 (0.32) DPP4ALDH1A1CYP2A6HPGDPDE9A
SCHEMBL16620526 0.95 ALDH1A1 (0.35) ALDH1A1HPGDGAAMAPTMAPK1
SCHEMBL16620527 0.95 ALDH1A1 (0.35) ALDH1A1HPGDGAAMAPTMAPK1
SCHEMBL17985094 0.83 DPP7 (0.37) DPP4
SCHEMBL17985092 0.83 DPP7 (0.37) DPP4
SCHEMBL16621026 0.82 SMN1; SMN2 (0.36) HPGDGAAMAPT
SCHEMBL16621025 0.82 SMN1; SMN2 (0.36) HPGDGAAMAPT
SCHEMBL16621186 0.79 DPP7 (0.34) ALDH1A1GAAMAPT
SCHEMBL16621187 0.79 DPP7 (0.34) ALDH1A1GAAMAPT
SCHEMBL14242382 0.79 DPP7 (0.34) ALDH1A1GAAMAPT

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