SCHEMBL5310310

SCHEMBL5310310

Cc1nn(Cc2cccc(Cl)c2)c(=O)c(CCc2cccc(F)c2)c1-c1ccccc1O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CASR P41180 11/20 0.50
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 2/20 0.40
EGLN1 Q9GZT9 1/20 0.40
MEN1 O00255 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.38
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38

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
SCHEMBL5312353 0.93 CASR (0.54) CASRPOLBRXFP1
SCHEMBL5310910 0.91 CASR (0.52) CASRLMNASMN1; SMN2POLBMEN1
SCHEMBL5310323 0.91 CASR (0.52) CASRSMN1; SMN2POLBMEN1HPGD
SCHEMBL5311393 0.89 CASR (0.50) CASRPOLBMEN1KMT2ARXFP1
SCHEMBL5309926 0.88 CASR (0.49) CASRSMN1; SMN2MEN1KMT2ARXFP1
SCHEMBL5313301 0.88 CASR (0.49) CASRSMN1; SMN2POLBMEN1KMT2A
SCHEMBL5309871 0.88 CASR (0.49) CASRPOLBHPGDRXFP1KDM4E
SCHEMBL5307893 0.88 THRB (0.41) CASRLMNASMN1; SMN2POLBMEN1
SCHEMBL5307948 0.88 CASR (0.49) CASRPOLBHPGDKDM4EALDH1A1
SCHEMBL5310145 0.86 CASR (0.51) CASRHPGDKDM4EALDH1A1

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