SCHEMBL9306320

SCHEMBL9306320

CCCCCCCCCCCCCCOc1ccc(C(=O)N(Cc2ccccn2)C(=O)c2ccccc2OC)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.49
HSD17B10 Q99714 1/20 0.49
PLK1 P53350 1/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
PLA2G4B P0C869 2/20 0.42
PARP10 Q53GL7 1/20 0.42
MAPT P10636 1/20 0.42
TRPM8 Q7Z2W7 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
SCHEMBL9306979 0.85 HPGD (0.56) HPGDHSD17B10TP53TSHRPLA2G4B
Iodide SCHEMBL9565573 0.80
SCHEMBL9306397 0.78 SMPD1 (0.52)
SCHEMBL9308491 0.78 THRA (0.51) PLA2G4B
SCHEMBL9306393 0.77 HPGD (0.54) HPGDHSD17B10PLK1TP53TSHR
SCHEMBL9308107 0.74 TRPM8 (0.55) HPGDHSD17B10TP53TSHRPLA2G4B
SCHEMBL9306665 0.74 SMPD1 (0.51) PLA2G4B
SCHEMBL8085972 0.74
SCHEMBL9308154 0.74 HSD17B10 (0.52) HPGDHSD17B10TP53TSHRPLA2G4B
SCHEMBL9306473 0.73 HPGD (0.51) HPGDHSD17B10TSHRTRPM8

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