SCHEMBL16620013

SCHEMBL16620013

Cc1ccc(/C=N/c2cccc(C#N)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.48
KDM4E B2RXH2 6/20 0.48
LMNA P02545 5/20 0.48
MAPT P10636 3/20 0.48
HPGD P15428 1/20 0.48
HTT P42858 1/20 0.48
CA2 P00918 2/20 0.42
CA9 Q16790 2/20 0.42
CA1 P00915 1/20 0.42
CA7 P43166 1/20 0.42
KMT2A Q03164 4/20 0.42
CYP2A6 P11509 1/20 0.41
PTGS2 P35354 2/20 0.41
PTGS1 P23219 1/20 0.41
CA12 O43570 1/20 0.41
GRIN2D O15399 2/20 0.40
GRIN3B O60391 2/20 0.40
GRIN1 Q05586 2/20 0.40
GRIN2A Q12879 2/20 0.40
GRIN2B Q13224 2/20 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
SCHEMBL16620014 1.00 ALDH1A1 (0.48) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL16620166 0.86 NPC1 (0.50) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL16620167 0.86 NPC1 (0.50) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL16621180 0.85 ALDH1A1 (0.55) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL16621084 0.84 GRIN2D (0.50) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL16620667 0.84 ALDH1A1 (0.46) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL16621083 0.84 GRIN2D (0.50) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL16620665 0.84 ALDH1A1 (0.46) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL16620621 0.83 GRIN2D (0.49) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL16620623 0.83 GRIN2D (0.49) ALDH1A1KDM4ELMNAMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10590208-B2 Polymers functionalized with imine compounds containing a cyano group BRIDGESTONE CORPORATION (JP) 2020-03-17 US claimed
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