SCHEMBL7085259

SCHEMBL7085259

Cc1cc(C(C)(C)C)c(NS(=O)(=O)N(C(=O)O)c2ccccc2)c(C(C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
HSD17B2 P37059 1/20 0.37
HPGD P15428 1/20 0.37
POLB P06746 2/20 0.37
NR4A1 P22736 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CA2 P00918 1/20 0.37
TYR P14679 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 1/20 0.35

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
SCHEMBL7081978 0.88 CA2 (0.37) HPGDALDH1A1CA2
SCHEMBL7085257 0.79 IDH1 (0.43) METAP2CA2
SCHEMBL7085484 0.78 ACLY (0.36) HPGDTDP1LMNA
SCHEMBL7168918 0.76
SCHEMBL7607216 0.76 NLRP3 (0.41)
SCHEMBL7081217 0.73 LMNA (0.34) HSD17B2HPGDLMNA
SCHEMBL7080899 0.71 LMNA (0.47) POLBLMNA
SCHEMBL7085483 0.71 ACLY (0.38) TDP1
SCHEMBL7085265 0.69 CYP2C19 (0.35) ALDH1A1LMNA
SCHEMBL7081215 0.69 CYP1A2 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0592439-B1 AMINOSULFONYL CARBAMATES WARNER LAMBERT CO (US) 2003-07-30 EP claimed
EP-0592439-B1 AMINOSULFONYL CARBAMATES WARNER LAMBERT CO (US) 2003-07-30 EP disclosed
US-5336690-A Anticholesterol agents WARNER-LAMBERT COMPANY (US) 1994-08-09 US disclosed
EP-0592439-A1 AMINOSULFONYL CARBAMATES WARNER-LAMBERT COMPANY (US) 1994-04-20 EP disclosed
US-5254715-A Anticholesterol agents WARNER-LAMBERT COMPANY (US) 1993-10-19 US disclosed
WO-1992008693-A1 AMINOSULFONYL CARBAMATES WARNER-LAMBERT COMPANY (US) 1992-05-29 WO disclosed