SCHEMBL8021428

SCHEMBL8021428

CC1c2sc(Cl)cc2CCN1C

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.44
ASIC3 Q9UHC3 1/20 0.37
DRD2 P14416 4/20 0.32
DRD1 P21728 4/20 0.32
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GLA P06280 1/20 0.30
CYP2D6 P10635 1/20 0.30
HPGD P15428 1/20 0.30
CASP1 P29466 1/20 0.30
CASP7 P55210 1/20 0.30
HSD17B10 Q99714 1/20 0.30
DRD5 P21918 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
SCHEMBL3308280 0.79 MAOA (0.44) MAOAASIC3DRD2KDM4EALDH1A1
SCHEMBL3308275 0.79 MAOA (0.44) MAOAASIC3DRD2KDM4EALDH1A1
SCHEMBL13560091 0.78 DRD1 (0.35) DRD2DRD1CYP2D6HSD17B10DRD5
SCHEMBL3308910 0.74 MAOA (0.43) MAOAKDM4EALDH1A1GLAHPGD
SCHEMBL3308872 0.74 MAOA (0.43) MAOAKDM4EALDH1A1GLAHPGD
SCHEMBL4428221 0.71 MAOA (0.40) MAOAALDH1A1
SCHEMBL13845087 0.71 HTR2A (0.30)
SCHEMBL13372899 0.69 MAOA (0.39) MAOADRD2DRD1ALDH1A1HPGD
SCHEMBL8032028 0.68 MAOA (0.64) MAOADRD2DRD1KDM4EALDH1A1
SCHEMBL3303648 0.68 MAOA (0.42) MAOADRD2DRD1DRD5

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
WO-2009095253-A1 6-HALO-PYRAZOLO[1, 5-A]PYRIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR (MGLUR) MODULATORS MERZ PHARMA GMBH & CO. KGAA (DE) 2009-08-06 WO disclosed