SCHEMBL4668710

SCHEMBL4668710

NS(=O)(=O)Oc1ccc(-c2cccc3ccccc23)cc1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA2 P00918 12/20 0.62
CA9 Q16790 12/20 0.62
CA1 P00915 11/20 0.62
CA12 O43570 7/20 0.62
PPARG P37231 7/20 0.50
PPARA Q07869 7/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
PPARD Q03181 1/20 0.50

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
Sulfamide SCHEMBL16394010 0.79 CA1 (0.69) CA2CA9CA1CA12PPARG
SCHEMBL12692388 0.78 CA2 (0.97) CA2CA9CA1CA12
SCHEMBL16634411 0.77 PPARG (0.55) CA2CA9CA1CA12PPARG
SCHEMBL4665451 0.77 CA2 (0.62) CA2CA9CA1CA12
SCHEMBL4668685 0.77 CA2 (0.62) CA2CA9CA1CA12
SCHEMBL4665426 0.77 CA2 (0.62) CA2CA9CA1CA12
SCHEMBL3798335 0.76 CA12 (0.62) CA2CA9CA1CA12PPARG
SCHEMBL7263619 0.75 CA2 (1.00) CA2CA9CA1CA12
SCHEMBL28069382 0.75 CA2 (0.73) CA2CA9CA1CA12
SCHEMBL30122908 0.74 CA12 (0.66) CA2CA9CA1CA12PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1193250-B1 PHENYL SULFAMATE DERIVATIVES TEIKOKU HORMONE MFG CO LTD (JP) 2008-06-04 EP disclosed
US-6762205-B1 STEROID SULFATASE INHIBITORS WITHOUT ESTROGENIC SIDE EFFECT ACTION TEIKOKU HORMONE MFG. CO., LTD. (JP) 2004-07-13 US disclosed
EP-1193250-A1 PHENYL SULFAMATE DERIVATIVES Teikoku Hormone Mfg. Co., Ltd. (JP) 2002-04-03 EP disclosed