SCHEMBL7085433

SCHEMBL7085433

Cc1cc(C(C)(C)C)c(N(C(=O)O)S(=O)(=O)Cl)c(C(C)(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 1/20 0.40
CA2 P00918 1/20 0.40
POLB P06746 1/20 0.40
TYR P14679 1/20 0.40
HSPA5 P11021 1/20 0.34
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33

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
SCHEMBL7085756 0.83 CA1 (0.45) SMN1; SMN2ALDH1A1CA2
SCHEMBL9139069 0.82 CA2 (0.38) ALDH1A1CA2
SCHEMBL9452033 0.80 ALDH1A1 (0.33) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL7082062 0.80 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL8754759 0.78 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL7168915 0.76 ALDH1A1 (0.34) ALDH1A1
SCHEMBL7085257 0.76 IDH1 (0.43) CA2
SCHEMBL7082049 0.76 ALDH1A1 (0.33) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL7085753 0.75 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1
SCHEMBL7081888 0.75 MEN1 (0.36) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0592439-B1 AMINOSULFONYL CARBAMATES WARNER LAMBERT CO (US) 2003-07-30 EP disclosed
US-5384328-A Anticholesterol agents WARNER-LAMBERT COMPANY (US) 1995-01-24 US disclosed
EP-0555351-B1 OXYSULFONYL CARBAMATES WARNER LAMBERT CO (US) 1994-12-28 EP 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
US-5245068-A Acylcoenzyme A cholesterol acyltransferase inhibitors WARNER-LAMBERT COMPANY (US) 1993-09-14 US disclosed
WO-1992008693-A1 AMINOSULFONYL CARBAMATES WARNER-LAMBERT COMPANY (US) 1992-05-29 WO disclosed
WO-1992007826-A1 OXYSULFONYL CARBAMATES WARNER-LAMBERT COMPANY (US) 1992-05-14 WO disclosed