SCHEMBL7082210

SCHEMBL7082210

CC(C)(C)c1cccc(C(C)(C)C)c1C(NC(=O)O)S(=O)(=O)NC(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 2/20 0.37
GAA P10253 1/20 0.37
LMNA P02545 1/20 0.37
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
ACLY P53396 1/20 0.34
KDM4E B2RXH2 1/20 0.34
TSHR P16473 1/20 0.34
HPGDS O60760 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
SCHEMBL7088314 0.77 LMNA (0.35) KMT2AALDH1A1GAALMNAACLY
SCHEMBL7088315 0.73 LMNA (0.34) KMT2AALDH1A1GAALMNA
SCHEMBL7081979 0.73 ACLY (0.38) ALDH1A1GAACA2ACLY
SCHEMBL9423113 0.70 ACLY (0.38) ALDH1A1GAALMNAACLYTSHR
SCHEMBL9423209 0.70 ACLY (0.36) ALDH1A1GAACA1CA2ACLY
SCHEMBL7085512 0.69 GAA (0.36) KMT2AALDH1A1GAALMNA
SCHEMBL9423213 0.69 DUT (0.36) MEN1KMT2AALDH1A1ACLY
SCHEMBL9423211 0.68 HTT (0.33) ALDH1A1GAACA1CA2ACLY
SCHEMBL7082216 0.68 DUT (0.34) ALDH1A1GAAACLY
SCHEMBL7085483 0.68 ACLY (0.38) ACLY

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-0592439-B1 AMINOSULFONYL CARBAMATES WARNER LAMBERT CO (US) 2003-07-30 EP claimed