SCHEMBL5481284

SCHEMBL5481284

Cc1cccc(Cn2nc(C)c(-c3ccccc3O)c(C(Cc3cccc(F)c3)c3cccc(F)c3)c2=O)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
CASR P41180 8/20 0.43
GNRHR P30968 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
IDO1 P14902 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
TDO2 P48775 1/20 0.38
CHRM1 P11229 1/20 0.37
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
P2RY14 Q15391 1/20 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
SCHEMBL5411840 0.93 CASR (0.43) POLBCASRGNRHRRXFP1CHRM1
SCHEMBL5460001 0.86 MEN1 (0.42) CASRGNRHRMEN1KMT2A
SCHEMBL5362360 0.84 CASR (0.48) CASRGNRHRMEN1KMT2A
SCHEMBL5477121 0.83 CASR (0.47) CASRGNRHRMEN1KMT2A
SCHEMBL5429119 0.83 CASR (0.42) POLBCASRSMN1; SMN2MAPTHPGD
SCHEMBL5419037 0.82 CASR (0.38) POLBCASRSMN1; SMN2MAPTHPGD
SCHEMBL5310323 0.81 CASR (0.52) POLBCASRRXFP1SMN1; SMN2MAPT
SCHEMBL5415146 0.80 CASR (0.37) CASRGNRHRMAPTHTT
SCHEMBL5425459 0.77 CASR (0.43) POLBCASRGNRHRMEN1KMT2A
SCHEMBL5312353 0.76 CASR (0.54) POLBCASRRXFP1

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-2007044796-A2 PYRIDAZINONE COMPOUNDS AS CALCILYTICS NPS PHARMACEUTICALS, INC. (US) 2007-04-19 WO disclosed