SCHEMBL5175246

SCHEMBL5175246

O=C(Cl)Oc1ccccc1S(=O)(=O)Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 3/20 0.37
ELANE P08246 2/20 0.36
ALDH1A1 P00352 3/20 0.35
HSD17B10 Q99714 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
HTR6 P50406 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA5A P35218 1/20 0.33
CA9 Q16790 1/20 0.33
MAPT P10636 2/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ESR1 P03372 1/20 0.32
ITGB3 P05106 1/20 0.32
ITGA2B P08514 1/20 0.32

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
SCHEMBL9323714 0.85 MYC (0.37) ELANEALDH1A1HSD17B10TDP1HTR6
SCHEMBL5175522 0.83 CA1 (0.46) CYP2C9CA1CA2CA5ACA9
SCHEMBL7257591 0.83 PTGS2 (0.50) TRPV4ALDH1A1HSD17B10TDP1CYP1A2
SCHEMBL11199429 0.83 BCAT2 (0.40) ELANEHTR6CYP1A2CYP2C9CYP2C19
SCHEMBL11070094 0.80 TRPV4 (0.34) TRPV4ELANEALDH1A1HSD17B10TDP1
SCHEMBL20582067 0.80 ELANE (0.57) ELANEALDH1A1CA2MAPT
SCHEMBL11070115 0.80 TRPV4 (0.34) TRPV4ELANEALDH1A1HSD17B10TDP1
SCHEMBL11242849 0.80 KMT2A (0.56) HSD17B10TDP1MAPTKMT2ASMN1; SMN2
SCHEMBL30524282 0.79 SERPINE1 (0.43) ELANEALDH1A1HSD17B10TDP1CYP1A2
SCHEMBL5696260 0.79 SERPINE1 (0.43) ELANEALDH1A1HSD17B10TDP1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1747231-A1 AMINOSULPHONYL- OR AMINOSULPHONYLAMINO-SUBSTITUTED PHENYL ESTERS AS ESTRIOL AND ESTETROL PRODRUGS Schering Aktiengesellschaft (DE) 2007-01-31 EP disclosed
EP-1747229-A1 STEROID PRODRUGS WITH ANDROGENIC EFFECT Schering Aktiengesellschaft (DE) 2007-01-31 EP disclosed
EP-1747230-A1 AMINOSULPHONYL-OR AMINOSULPHONYLAMINO-SUBSTITUTED PHENYL ESTERS AS ESTRADIOL PRODRUGS Schering Aktiengesellschaft (DE) 2007-01-31 EP disclosed
WO-2005113574-A1 AMINOSULPHONYL- OR AMINOSULPHONYLAMINO-SUBSTITUTED PHENYL ESTERS AS ESTRADIOL PRODRUGS SCHERING AKTIENGESELLSCHAFT (DE) 2005-12-01 WO disclosed
WO-2005113576-A1 AMINOSULPHONYL- OR AMINOSULPHONYLAMINO-SUBSTITUTED PHENYL ESTERS AS ESTRIOL AND ESTETROL PRODRUGS SCHERING AKTIENGESELLSCHAFT (DE) 2005-12-01 WO disclosed
WO-2005113575-A1 STEROID PRODRUGS WITH ANDROGENIC EFFECT SCHERING AKTIENGESELLSCHAFT (DE) 2005-12-01 WO disclosed