SCHEMBL4668688

SCHEMBL4668688

COc1ccc(-c2ccc(NS(C)(=O)=O)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.72
GAA P10253 1/20 0.72
MAPK1 P28482 1/20 0.72
KIF11 P52732 4/20 0.65
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
PLAU P00749 2/20 0.58
PGR P06401 1/20 0.58
TP53 P04637 1/20 0.56
PTGS2 P35354 2/20 0.53
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
PTGS1 P23219 1/20 0.51
ALDH1A1 P00352 2/20 0.50
HPGD P15428 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 1/20 0.50
HTT P42858 1/20 0.50
AR P10275 1/20 0.50
KEAP1 Q14145 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
SCHEMBL171658 0.94 LMNA (0.79) LMNAGAAMAPK1KIF11CA1
SCHEMBL3116450 0.89 PGR (0.73) LMNAGAAMAPK1KIF11CA1
SCHEMBL31041151 0.85 KIF11 (0.79) LMNAKIF11CA1CA2PGR
SCHEMBL24689849 0.84 LMNA (0.66) LMNAGAAMAPK1KIF11CA1
SCHEMBL3985582 0.84 LMNA (0.76) LMNAGAAMAPK1KIF11CA1
Lithium SCHEMBL31041154 0.83 KIF11 (0.76) LMNAKIF11CA1CA2PGR
SCHEMBL28082142 0.82 RAB9A (0.73) LMNAGAAMAPK1CA1CA2
SCHEMBL3468171 0.82 LMNA (0.64) LMNAGAAMAPK1CA1CA2
SCHEMBL32679643 0.81 GAA (0.78) LMNAGAAMAPK1PLAUPGR
SCHEMBL3376915 0.80 PGR (0.90) KIF11PGRNPC1RAB9AHPGD

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