SCHEMBL9306665

SCHEMBL9306665

CCCCCCCCCCCCCCOc1cccc(C(=O)N(Cc2ccccn2)C(C)=O)c1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.51
PLA2G4B P0C869 1/20 0.51
THRA P10827 1/20 0.50
THRB P10828 1/20 0.50
KMT2A Q03164 1/20 0.48
NR1H4 Q96RI1 1/20 0.47

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
SCHEMBL9306979 0.88 HPGD (0.56) PLA2G4B
SCHEMBL8085972 0.85
SCHEMBL9306557 0.83 THRA (0.51) THRATHRB
SCHEMBL9308491 0.83 THRA (0.51) SMPD1PLA2G4BTHRATHRB
SCHEMBL9306397 0.83 SMPD1 (0.52) SMPD1
SCHEMBL9306021 0.81 THRA (0.52) THRATHRB
SCHEMBL9306402 0.81 THRA (0.52) THRATHRB
SCHEMBL9308313 0.80 CYP2D6 (0.47) SMPD1PLA2G4B
SCHEMBL9308107 0.80 TRPM8 (0.55) PLA2G4B
Iodide SCHEMBL9306673 0.79

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