SCHEMBL9684081

SCHEMBL9684081

CCc1[nH]c(-c2ccc(C)cc2)c(C#N)c1Br

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
GRIA2 P42262 1/20 0.39
GRIA4 P48058 1/20 0.39
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
PDE9A O76083 6/20 0.36
KDM4E B2RXH2 4/20 0.36
HPGD P15428 4/20 0.36
PPARG P37231 1/20 0.36
NCOA2 Q15596 1/20 0.36
NCOA1 Q15788 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36
PDE1C Q14123 1/20 0.36
GAA P10253 4/20 0.35
ALDH1A1 P00352 4/20 0.35
GLA P06280 2/20 0.35
MEN1 O00255 2/20 0.35
MAPT P10636 2/20 0.35
KMT2A Q03164 2/20 0.35

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
SCHEMBL9684667 0.76 POLB (0.48) POLBMAOAMAOBPDE9AKDM4E
SCHEMBL21529737 0.75 POLB (0.47) POLBMAOAMAOBPDE9AKDM4E
SCHEMBL9683351 0.70 POLB (0.48) POLBMAOAMAOBPDE9AKDM4E
SCHEMBL12313417 0.69 MAPT (0.43) POLBMAOAMAOBKDM4EHPGD
SCHEMBL9228244 0.67 ALDH1A1 (0.40) POLBGRIA2GRIA4KDM4EHPGD
SCHEMBL1180120 0.66 DYRK1A (0.43) POLBKDM4EHPGDPPARGNPSR1
SCHEMBL15996359 0.66 POLB (0.50) POLBMAOAMAOBPDE9AKDM4E
SCHEMBL9042245 0.65 PDE9A (0.46) POLBPDE9AKDM4EHPGDPPARG
SCHEMBL10590025 0.65 KMT2A (0.40) POLBKDM4EGAAALDH1A1GLA
SCHEMBL9518605 0.65 DYRK1A (0.39) POLBKDM4EHPGDPPARGNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0480204-A1 Imidazole derivatives, potent and selective antagonists of angiotensin II receptor FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-04-15 EP disclosed