SCHEMBL9304941

SCHEMBL9304941

CCCCCCCCCCCCCCOc1ccc(CC(=O)O)cc1Cl

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 2/20 0.62
PTPN1 P18031 1/20 0.62
PTPN6 P29350 1/20 0.62
THRA P10827 3/20 0.57
THRB P10828 3/20 0.57
ATM Q13315 1/20 0.56
S1PR2 O95136 1/20 0.56
S1PR1 P21453 1/20 0.56
S1PR3 Q99500 1/20 0.56
LPAR2 Q9HBW0 1/20 0.56
LTB4R Q15722 2/20 0.55
LTB4R2 Q9NPC1 2/20 0.55
PLA2G4B P0C869 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
GLA P06280 1/20 0.53
PPARG P37231 1/20 0.53
NR1H2 P55055 1/20 0.53
PPARD Q03181 1/20 0.53
PPARA Q07869 1/20 0.53
NR1H3 Q13133 1/20 0.53

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
SCHEMBL5144262 0.94 ATM (0.62) PTPN11PTPN1PTPN6THRATHRB
SCHEMBL4321455 0.90 CSNK2A1 (0.63) PTPN11PTPN1PTPN6ATMLTB4R
SCHEMBL9309743 0.89 ATM (0.56) PTPN11PTPN1PTPN6THRATHRB
SCHEMBL5093658 0.87 PTPN11 (0.66) PTPN11PTPN1PTPN6THRATHRB
SCHEMBL5138907 0.87 PTPN11 (0.66) PTPN11PTPN1PTPN6THRATHRB
SCHEMBL9307491 0.86 S1PR2 (0.57) PTPN11PTPN1PTPN6THRATHRB
SCHEMBL10899796 0.84 CA2 (0.56) THRBLTB4RLTB4R2SMN1; SMN2PPARG
SCHEMBL9306902 0.83 PTPN11 (0.62) PTPN11PTPN1PTPN6THRATHRB
SCHEMBL9398842 0.82 SMN1; SMN2 (0.70) THRATHRBATMS1PR2S1PR1
SCHEMBL18682278 0.81 THRA (0.68) PTPN11THRATHRBPLA2G4BTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5328921-A Antagonist of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1994-07-12 US disclosed
US-5208247-A Antianaphylactic agents or septic shock AMERICAN CYANAMID COMPANY (US) 1993-05-04 US disclosed
EP-0530444-A1 Aryl, amide, imide, and carbamate pyridine antagonists of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1993-03-10 EP disclosed