SCHEMBL27592385

SCHEMBL27592385

Cc1ccc(S(=O)(=O)N(C)c2cccc(-c3ccc(C(=O)O)s3)c2)c(C)c1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 11/20 0.50
▸ HSD17B2 P37059 11/20 0.50
▸ HPGDS O60760 1/20 0.46
▸ MEN1 O00255 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ KMT2A Q03164 1/20 0.44

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
SCHEMBL2158088 0.76 — —
SCHEMBL5842337 0.75 HPGDS (0.69) HSD17B1HSD17B2HPGDSMEN1POLB
SCHEMBL3814674 0.72 GAA (0.40) HSD17B1HSD17B2
SCHEMBL3756385 0.69 POLB (0.70) HSD17B1HSD17B2HPGDSMEN1POLB
SCHEMBL2157712 0.67 — —
SCHEMBL1761545 0.67 RAB9A (0.92) HPGDSMEN1POLBRAB9AKMT2A
SCHEMBL24573407 0.67 HPGD (0.66) HSD17B1HSD17B2MEN1POLBRAB9A
SCHEMBL6260315 0.66 RAB9A (0.83) HPGDSMEN1POLBRAB9AKMT2A
SCHEMBL5605082 0.65 HSD17B1 (0.60) HSD17B1HSD17B2HPGDS
SCHEMBL3639170 0.65 HPGDS (1.00) HSD17B1HSD17B2HPGDSMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1602308-A Thiophene derivatives as antiviral agents against flavivirus infections VIRUS CHEM PHARMA INC (CA) 2005-03-30 — — CN claimed
CN-101624391-A Thiophene derivatives as antiviral agents for flavivirus infection VIROCHEM PHARMA INC 2010-01-13 — — CN disclosed
CN-100509797-C Thiophene derivatives as antiviral agents against flavivirus infections VIRUS CHEM PHARMA INC (CA) 2009-07-08 — — CN disclosed
CN-1602308-A Thiophene derivatives as antiviral agents against flavivirus infections VIRUS CHEM PHARMA INC (CA) 2005-03-30 — — CN disclosed
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