SCHEMBL10242588

SCHEMBL10242588

CC(C)N(C)S(=O)(=O)NC(=O)c1cc(NC(=O)C2CO2)c(F)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 18/20 0.40
CYP2C19 P33261 1/20 0.38
SCN5A Q14524 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL25047105 0.82 SCN9A (0.43) SCN9ACYP2C19
SCHEMBL712255 0.82 SCN9A (0.45) SCN9ACYP2C19
SCHEMBL12011295 0.81 HDAC6 (0.39)
SCHEMBL709376 0.79 SCN9A (0.43) SCN9ACYP2C19HPGD
SCHEMBL25046395 0.76 SCN9A (0.42) SCN9ACYP2C19HPGD
SCHEMBL713577 0.76 SCN9A (0.46) SCN9ACYP2C19
SCHEMBL31118371 0.74 SCN9A (0.45) SCN9ACYP2C19
SCHEMBL3059734 0.72 SCN9A (0.43) SCN9ACYP2C19
SCHEMBL974515 0.71 SCN9A (0.43) SCN9ACYP2C19
SCHEMBL4062938 0.67 SCN9A (0.40) SCN9ACYP2C19

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8252925-B2 Method for the production of 3-phenyl(thio)uracils and dithiouracils BASF AKTIENGESELLSCHAFT (DE) 2012-08-28 US disclosed
US-8124818-B2 Method for the production of 3-phenyl(thio) uracils and dithiouracils BASF AKTIENGESELLSCHAFT (DE) 2012-02-28 US disclosed