SCHEMBL9712405

SCHEMBL9712405

Cc1cc(C)c(F)c([C]=O)c1F

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL8119941 0.78
SCHEMBL1197431 0.73 ACHE (0.32) TRPA1CYP3A4
SCHEMBL9116623 0.73
SCHEMBL1311844 0.72 CYP3A4 (0.32) TRPA1CYP3A4
SCHEMBL3974422 0.72 CA1 (0.39)
SCHEMBL10701289 0.70 MAPK1 (0.33) CYP3A4
SCHEMBL9209444 0.70 HDAC1 (0.31)
SCHEMBL11415517 0.70 CYP3A4 (0.35) CYP3A4
SCHEMBL317183 0.70
SCHEMBL8116820 0.69 HDAC1 (0.32)

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
US-5117057-A Insecticidal N' substituted-N-N'-disubstituted-hydrazines ROHM AND HAAS COMPANY (US) 1992-05-26 US disclosed