SCHEMBL11267887

SCHEMBL11267887

CC(C)C(C(=O)OCc1cccc(Oc2ccc(F)cc2)n1)C(C)C=C(Cl)Cl

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 4/20 0.38
P2RX3 P56373 13/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PPARG P37231 1/20 0.35

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
SCHEMBL11267837 0.92 SCN9A (0.37) SCN9AP2RX3MEN1KMT2APPARG
SCHEMBL11271875 0.91 SCN9A (0.37) SCN9AP2RX3MEN1KMT2APPARG
SCHEMBL11279540 0.91 P2RX3 (0.43) P2RX3
SCHEMBL11284589 0.91 P2RX3 (0.43) P2RX3PPARG
SCHEMBL11273182 0.91 P2RX3 (0.38) P2RX3MEN1KMT2A
SCHEMBL11282323 0.89 P2RX3 (0.35) P2RX3
SCHEMBL11275035 0.88 P2RX3 (0.35) P2RX3
SCHEMBL11274809 0.84 SCN9A (0.38) SCN9AP2RX3MEN1KMT2APPARG
SCHEMBL11270567 0.82 P2RX3 (0.42) P2RX3
SCHEMBL11266232 0.82 CARM1 (0.36) KMT2A

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-4338326-A PESTICIDES UNION CARBIDE CORPORATION (US) 1982-07-06 US disclosed