SCHEMBL20868354

SCHEMBL20868354

CSNC(=O)c1cc(C2CC2)c(COCC2(F)CCN(C(=O)c3ccc(F)cc3Cl)CC2)cc1F

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.41
▸ SCN9A Q15858 8/20 0.40
▸ HSD11B1 P28845 1/20 0.38
▸ OPRL1 P41146 5/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ UBE2M P61081 1/20 0.35
▸ DCUN1D1 Q96GG9 1/20 0.35
▸ P2RX7 Q99572 1/20 0.35
▸ SCN7A Q01118 1/20 0.34
▸ SCN5A Q14524 1/20 0.34
▸ DRD2 P14416 1/20 0.34
▸ DRD3 P35462 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
SCHEMBL20868353 0.89 SCN9A (0.51) SCN9ASCN7ASCN5A
SCHEMBL20868523 0.88 SCN9A (0.47) SCN9AMEN1ALDH1A1KMT2AP2RX7
SCHEMBL20868203 0.87 NPC1 (0.39) NPC1SCN9AHSD11B1OPRL1MEN1
SCHEMBL20868344 0.87 SCN7A (0.47) SCN9ASCN7ASCN5A
SCHEMBL20868025 0.79 SCN9A (0.45) SCN9ASCN7ASCN5A
SCHEMBL20868012 0.77 SCN9A (0.60) SCN9ASCN7ASCN5A
SCHEMBL20868267 0.77 SCN9A (0.51) SCN9ASCN7ASCN5A
SCHEMBL20868201 0.77 SCN5A (0.48) SCN9ASCN7ASCN5A
SCHEMBL20868072 0.76 SCN5A (0.45) SCN9ASCN7ASCN5A
SCHEMBL20868381 0.75 SCN9A (0.54) SCN9ASCN7ASCN5A

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
WO-2019062848-A1 N-(SUBSTITUTED SULFONYL)BENZAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL USE THEREOF 浙江海正药业股份有限公司 2019-04-04 — — WO disclosed
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