SCHEMBL9308501

SCHEMBL9308501

CCCCCCCCCCCCCCOc1ccc(COC(=O)N(Cc2ccccn2)C(C)=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ENPP2 Q13822 1/20 0.45
LPAR3 Q9UBY5 1/20 0.43
PLA2G4B P0C869 2/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 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
SCHEMBL9308107 0.83 TRPM8 (0.55) HPGDHSD17B10PLA2G4BTP53TSHR
SCHEMBL9306979 0.83 HPGD (0.56) HPGDHSD17B10PLA2G4BTP53TSHR
SCHEMBL9695135 0.83
SCHEMBL9695110 0.83
SCHEMBL9306473 0.82 HPGD (0.51) HPGDHSD17B10ENPP2TSHRKDM4E
Iodide SCHEMBL9565597 0.80
SCHEMBL9695552 0.79
SCHEMBL9696007 0.79
SCHEMBL9695412 0.79
SCHEMBL9695154 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