SCHEMBL4667240

SCHEMBL4667240

CS(=O)(=O)Oc1ccc(N(Cc2ccc(OCc3ccccc3)cc2)S(C)(=O)=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.61
ALDH1A1 P00352 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.55
LMNA P02545 1/20 0.55
GRM2 Q14416 1/20 0.53
POLB P06746 1/20 0.49
ALOX5 P09917 1/20 0.49
PTGS1 P23219 1/20 0.49
PTGS2 P35354 1/20 0.49
PTPN6 P29350 2/20 0.48
PTPN11 Q06124 1/20 0.48
PPARG P37231 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
AR P10275 2/20 0.48
NPC1 O15118 1/20 0.48
HPGD P15428 1/20 0.48
RAB9A P51151 1/20 0.48
PTPN2 P17706 1/20 0.47
NR3C1 P04150 1/20 0.46
TSPO P30536 1/20 0.46

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
SCHEMBL2004893 0.84 AR (0.64) SMN1; SMN2LMNAPTGS1PTGS2PPARG
SCHEMBL4668653 0.83 PTPN1 (0.44) PTPN1ALDH1A1SMN1; SMN2LMNAPOLB
SCHEMBL5184334 0.78 LMNA (0.69) ALDH1A1SMN1; SMN2LMNAALOX5PTGS1
SCHEMBL8999638 0.78 ALDH1A1 (0.63) PTPN1ALDH1A1SMN1; SMN2LMNAALOX5
SCHEMBL6735454 0.78 GRM2 (0.71) PTPN1ALDH1A1SMN1; SMN2LMNAGRM2
SCHEMBL5184339 0.78 KMT2A (0.61) SMN1; SMN2LMNAALOX5PTGS1PTGS2
SCHEMBL874437 0.76 AR (0.62) SMN1; SMN2LMNAALOX5PTGS1PTGS2
SCHEMBL4773148 0.76 ALDH1A1 (0.56) PTPN1ALDH1A1SMN1; SMN2LMNAGRM2
SCHEMBL10561547 0.76 GRM2 (0.60) SMN1; SMN2LMNAGRM2
SCHEMBL12808838 0.76 ALDH1A1 (0.60) PTPN1ALDH1A1SMN1; SMN2LMNAPOLB

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