SCHEMBL10653103

SCHEMBL10653103

CSc1sc(Cl)c(-c2ccc(C)cc2)c1C#N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 2/20 0.50
GRIA2 P42262 1/20 0.47
KMT2A Q03164 5/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
KDM4E B2RXH2 7/20 0.41
NPSR1 Q6W5P4 4/20 0.41
MAPK1 P28482 4/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
FNTA P49354 2/20 0.40
FNTB P49356 2/20 0.40
HSD17B10 Q99714 3/20 0.40
MEN1 O00255 3/20 0.40
MAPT P10636 2/20 0.40
HTT P42858 2/20 0.40
ALOX15 P16050 2/20 0.40
LMNA P02545 1/20 0.40
ALDH1A1 P00352 5/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL10651230 0.89 GRIA4 (0.51) GRIA4GRIA2KMT2AKDM4ENPSR1
SCHEMBL5758052 0.78 GRIA4 (0.64) GRIA4GRIA2KMT2AKDM4EFNTA
SCHEMBL10655092 0.77 GRIA4 (0.41) GRIA4GRIA2KMT2AKDM4ENPSR1
SCHEMBL10654112 0.76 GRIA4 (0.61) GRIA4GRIA2KMT2AKDM4ENPSR1
SCHEMBL10654301 0.72 CTSS (0.42) GRIA4GRIA2KMT2AKDM4ENPSR1
SCHEMBL16792125 0.71 GRIA4 (0.78) GRIA4GRIA2KMT2AFNTAFNTB
SCHEMBL5756967 0.71 GRIA4 (0.62) GRIA4GRIA2KMT2AKDM4EMAPK1
SCHEMBL10655972 0.70 GRIA4 (0.41) GRIA4GRIA2KMT2AKDM4ENPSR1
SCHEMBL10652865 0.70 GRIA4 (0.60) GRIA4GRIA2KMT2ANPSR1L3MBTL1
SCHEMBL10655979 0.70 GRIA4 (0.34) GRIA4GRIA2KDM4ENPSR1MAPK1

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-0273602-A1 3-Cyano-4-arylthiophenes ELI LILLY AND COMPANY (US) 1988-07-06 EP disclosed