SCHEMBL3815949

SCHEMBL3815949

Fc1ccc(-c2cc[c]s2)nc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.33
MAPT P10636 1/20 0.31
NPC1 O15118 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
HDAC1 Q13547 2/20 0.31
SCD O00767 1/20 0.30
SCD5 Q86SK9 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
SCHEMBL4893403 0.78 CASP3 (0.34) GRM5MAPTNPC1HDAC1SCD
SCHEMBL811754 0.72 GRM5 (0.47) GRM5MAPTNPC1RXFP1
SCHEMBL1415990 0.70 HSD17B1 (0.36) MAPTNPC1
SCHEMBL3607890 0.68 HSP90AA1 (0.39) GRM5
SCHEMBL7427844 0.68 KDM4E (0.48) MAPTNPC1RXFP1
SCHEMBL3835184 0.67 NPC1 (0.44) GRM5NPC1RXFP1
SCHEMBL21551796 0.67 KDM4E (0.34) MAPT
SCHEMBL9077074 0.67
SCHEMBL533422 0.65 KDM4A (0.38) NPC1
SCHEMBL23348866 0.65 GRM5 (0.44) GRM5MAPTNPC1RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2091937-A2 SUBSTITUTED IMIDAZOLES AS BOMBESIN RECEPTOR SUBTYPE-3 MODULATORS Merck & Co., Inc. (US) 2009-08-26 EP disclosed
WO-2008051406-A2 SUBSTITUTED IMIDAZOLES AS BOMBESIN RECEPTOR SUBTYPE-3 MODULATORS MERCK & CO., INC. (US) 2008-05-02 WO disclosed