SCHEMBL9402699

SCHEMBL9402699

CCCCCCCCCCCCCCCCCCOc1ccc(OCc2ccc(Cl)cc2)c(C(=O)N(CC(=O)O)CC(=O)O)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 5/20 0.46
▸ MRGPRX4 Q96LA9 1/20 0.43
▸ PLA2G2A P14555 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ MAOB P27338 3/20 0.43
▸ PTPN1 P18031 1/20 0.43
▸ PTPN6 P29350 1/20 0.43
▸ MAOA P21397 2/20 0.42
▸ THRA P10827 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ PLA2G4B P0C869 2/20 0.42
▸ NR4A2 P43354 1/20 0.41

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
SCHEMBL9402789 0.92 PTPN11 (0.47) PTPN11PLA2G2ABLMPTPN1PTPN6
SCHEMBL9402646 0.91 PTPN11 (0.50) PTPN11PLA2G2ABLMMAOBPLA2G4B
SCHEMBL9402877 0.91 PTPN11 (0.50) PTPN11PLA2G2ABLMMAOBPLA2G4B
SCHEMBL9402542 0.91 PTPN11 (0.50) PTPN11PLA2G2ABLMMAOBPLA2G4B
SCHEMBL9403014 0.90 PTPN11 (0.46) PTPN11PLA2G2ABLMPTPN1PTPN6
SCHEMBL9402533 0.87 PLA2G2A (0.52) PTPN11PLA2G2ABLMPTPN1PTPN6
SCHEMBL9402707 0.87 PLA2G2A (0.52) PTPN11PLA2G2ABLMPTPN1PTPN6
SCHEMBL9402594 0.87 CYSLTR2 (0.46) PTPN11PLA2G2ABLMMAOBPTPN1
SCHEMBL9402565 0.86 PTPN11 (0.47) PTPN11PLA2G2ABLMPTPN1PTPN6
SCHEMBL9403064 0.85 PTPN11 (0.48) PTPN11PLA2G2ABLMPLA2G4B

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
US-5298652-A N-substituted glycines, inhibitors of phospholipase A2 HOFFMANN-LA ROCHE INC. (US) 1994-03-29 — — US disclosed
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