SCHEMBL11267883

SCHEMBL11267883

COC(=O)C(c1cccc(Oc2ccc(F)cc2)n1)(C(C)C)C(C)C=C(Cl)Cl

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 11/20 0.38
FPR2 P25090 7/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
P2RX3 P56373 5/20 0.34
PPARG P37231 1/20 0.34
POLB P06746 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL11273179 0.92 FPR2 (0.37) SCN9AFPR2MEN1KMT2AP2RX3
SCHEMBL11267834 0.91 SCN9A (0.38) SCN9AFPR2MEN1KMT2AP2RX3
SCHEMBL11284587 0.91 P2RX3 (0.40) SCN9AFPR2P2RX3
SCHEMBL11279536 0.91 P2RX3 (0.39) SCN9AFPR2MEN1KMT2AP2RX3
SCHEMBL11275031 0.90 FPR2 (0.36) SCN9AFPR2P2RX3POLB
SCHEMBL11271872 0.89 SCN9A (0.36) SCN9AFPR2MEN1KMT2AP2RX3
SCHEMBL11282320 0.88 FPR2 (0.35) SCN9AFPR2P2RX3
SCHEMBL11266217 0.83 ALDH1A1 (0.36) MEN1KMT2A
SCHEMBL11270557 0.82 P2RX3 (0.38) SCN9AFPR2MEN1KMT2AP2RX3
SCHEMBL11282333 0.80 P2RX3 (0.39) SCN9AFPR2MEN1KMT2AP2RX3

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