SCHEMBL23677166

SCHEMBL23677166

Cc1cnc(OCC(F)(F)C(C)F)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.41
AAK1 Q2M2I8 8/20 0.39
SCN9A Q15858 9/20 0.37
MAPK1 P28482 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL15599341 0.90 SCN9A (0.44) SSTR4AAK1SCN9AMAPK1CYP1A2
SCHEMBL19673352 0.85 SSTR4 (0.39) SSTR4AAK1SCN9ACYP1A2CYP3A4
SCHEMBL17428846 0.83 SSTR4 (0.45) SSTR4AAK1SCN9ACYP1A2CYP3A4
SCHEMBL23677235 0.82 SSTR4 (0.40) SSTR4AAK1SCN9A
SCHEMBL15599218 0.81 SSTR4 (0.47) SSTR4AAK1CYP1A2CYP3A4CYP2C19
SCHEMBL24599916 0.80 SSTR4 (0.44) SSTR4AAK1CYP1A2CYP3A4CYP2C19
SCHEMBL22746004 0.77 SSTR4 (0.41) SSTR4AAK1CYP1A2CYP3A4CYP2C19
SCHEMBL15599216 0.76 SCN9A (0.44) SSTR4AAK1SCN9ACYP3A4
SCHEMBL17244897 0.75 SCN9A (0.42) AAK1SCN9AMAPK1
SCHEMBL15599221 0.75 PTGS2 (0.51) SSTR4AAK1

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-3854782-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF Genentech, Inc. (US) 2021-07-28 EP disclosed