SCHEMBL9051601

SCHEMBL9051601

NC(=O)C(C1CCc2[c]cccc2C1)N(c1ccccc1)c1cccnc1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 2/20 0.32
NR1I2 O75469 1/20 0.32
TAOK1 Q7L7X3 1/20 0.31
TSHR P16473 1/20 0.31
PTGIR P43119 1/20 0.31
CYP3A4 P08684 1/20 0.31
SLC18A3 Q16572 1/20 0.31

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
SCHEMBL9568065 0.82 KCNA5 (0.30)
SCHEMBL9048217 0.79 TRPM8 (0.34) TRPM8NR1I2TAOK1TSHRPTGIR
SCHEMBL9047207 0.78 TBXAS1 (0.52) PTGIR
SCHEMBL9427288 0.77 TBXAS1 (0.40) TRPM8NR1I2PTGIR
SCHEMBL9567954 0.72 MTNR1A (0.34) TRPM8
SCHEMBL9568061 0.71 PTGIR (0.36) PTGIRSLC18A3
SCHEMBL9427435 0.68 PTGIR (0.33) TRPM8PTGIR
SCHEMBL9050333 0.67 PTGIR (0.56) PTGIR
SCHEMBL9568045 0.67 TAOK1 (0.39) TRPM8NR1I2TAOK1SLC18A3
SCHEMBL9427442 0.65 PTGIR (0.41) PTGIR

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
EP-0542203-B1 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO (JP) 1996-07-03 EP claimed