SCHEMBL13270767

SCHEMBL13270767

B=C(O)c1sc(-c2ccccc2)cc1N(C)S(=O)(=O)c1cc(C)c(Cl)cc1C

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.39
▸ ACLY P53396 2/20 0.38
▸ S1PR1 P21453 1/20 0.38
▸ HSD17B1 P14061 1/20 0.37
▸ HSD17B2 P37059 1/20 0.37
▸ MAPT P10636 1/20 0.36

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
SCHEMBL2158554 0.91 — —
SCHEMBL3814650 0.83 ACLY (0.39) LMNAACLYS1PR1HSD17B1HSD17B2
SCHEMBL2158088 0.75 — —
SCHEMBL2157632 0.73 MEN1 (0.40) LMNA
SCHEMBL2157474 0.71 NPSR1 (0.55) ACLYHSD17B1HSD17B2
SCHEMBL2157610 0.71 NPC1 (0.33) —
SCHEMBL2157369 0.71 MAPT (0.40) LMNAMAPT
SCHEMBL4764323 0.70 CA12 (0.40) LMNAHSD17B1HSD17B2
SCHEMBL2158593 0.70 IKBKB (0.59) HSD17B1HSD17B2
SCHEMBL2157626 0.69 MAPT (0.56) LMNAMAPT

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-2206709-A2 Thiophene derivatives as antiviral agents for flavivirus infection Virochem Pharma Inc. (CA) 2010-07-14 — — EP disclosed
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