SCHEMBL17985131

SCHEMBL17985131

N#CC1CCC(=Nc2ccccc2)C1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34

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
SCHEMBL17985128 1.00 CYP1A2 (0.34) CYP1A2CYP11B1CYP11B2
SCHEMBL17985151 0.90 ALDH1A1 (0.33) CYP1A2CYP11B1CYP11B2
SCHEMBL17985152 0.90 ALDH1A1 (0.33) CYP1A2CYP11B1CYP11B2
SCHEMBL17985127 0.89 KDM4E (0.34) CYP1A2CYP11B1CYP11B2
SCHEMBL16620468 0.83 ALDH1A1 (0.31) CYP1A2CYP11B1CYP11B2
SCHEMBL16620467 0.83 ALDH1A1 (0.31) CYP1A2CYP11B1CYP11B2
SCHEMBL16621218 0.82 SMN1; SMN2 (0.36) CYP1A2CYP11B1CYP11B2
SCHEMBL16621217 0.82 SMN1; SMN2 (0.36) CYP1A2CYP11B1CYP11B2
SCHEMBL16620210 0.78 ALDH1A1 (0.35) CYP1A2CYP11B1CYP11B2
SCHEMBL16620211 0.78 ALDH1A1 (0.35) CYP1A2CYP11B1CYP11B2

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