SCHEMBL17985152

SCHEMBL17985152

N#CC1CCCC(=Nc2ccccc2)C1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
POLB P06746 1/20 0.31
TP53 P04637 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
SCHEMBL17985151 1.00 ALDH1A1 (0.33) ALDH1A1KDM4EMAPTMAPK1POLB
SCHEMBL17985128 0.90 CYP1A2 (0.34) CYP1A2CYP11B1CYP11B2
SCHEMBL17985131 0.90 CYP1A2 (0.34) CYP1A2CYP11B1CYP11B2
SCHEMBL16620217 0.84 MAOB (0.30)
SCHEMBL16620215 0.84 MAOB (0.30)
SCHEMBL16620965 0.83 SMN1; SMN2 (0.35) ALDH1A1MAPTMAPK1
SCHEMBL16620964 0.83 SMN1; SMN2 (0.35) ALDH1A1MAPTMAPK1
SCHEMBL17985127 0.80 KDM4E (0.34) ALDH1A1KDM4ECYP1A2CYP11B1CYP11B2
SCHEMBL16620333 0.79 ALDH1A1 (0.33) ALDH1A1KDM4EMAPTMAPK1TP53
SCHEMBL16620334 0.79 ALDH1A1 (0.33) ALDH1A1KDM4EMAPTMAPK1TP53

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 4 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