SCHEMBL499117

SCHEMBL499117

O=C(O)CSCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.64
HTT P42858 1/20 0.61
CYP1A2 P05177 2/20 0.59
MMP12 P39900 1/20 0.56
MMP13 P45452 1/20 0.56
ALDH1A1 P00352 2/20 0.55
PAM P19021 1/20 0.53
POLB P06746 1/20 0.52
SMN1; SMN2 Q16637 4/20 0.51
RAB9A P51151 3/20 0.51
NPC1 O15118 2/20 0.51
MAPT P10636 2/20 0.51
FFAR1 O14842 1/20 0.50
AKR1B1 P15121 1/20 0.50
NFKB1 P19838 1/20 0.49
CASP3 P42574 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49

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
SCHEMBL11546209 0.90 CYP2C19 (0.58) CYP2C19HTTCYP1A2MMP12MMP13
SCHEMBL8334278 0.88 MMP12 (0.69) CYP2C19HTTCYP1A2MMP12MMP13
SCHEMBL20395222 0.86 CYP2C19 (0.59) CYP2C19HTTCYP1A2ALDH1A1SMN1; SMN2
SCHEMBL13865680 0.85 HTT (0.56) CYP2C19HTTCYP1A2MMP12MMP13
SCHEMBL1478837 0.84 MEN1 (0.66) CYP2C19ALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL721637 0.84 CYP2C19 (0.57) CYP2C19HTTCYP1A2ALDH1A1SMN1; SMN2
SCHEMBL5840786 0.84 CYP2C19 (0.57) CYP2C19HTTCYP1A2ALDH1A1SMN1; SMN2
SCHEMBL10560722 0.84 CYP2C19 (0.56) CYP2C19HTTCYP1A2ALDH1A1SMN1; SMN2
SCHEMBL1270437 0.83 HTT (0.62) CYP2C19HTTCYP1A2MMP12MMP13
Hydrochloric Acid SCHEMBL5506583 0.83 MEN1 (0.63) CYP2C19ALDH1A1SMN1; SMN2RAB9ANPC1

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 355 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3962917-A1 METHOD FOR THE MANUFACTURE OF ALKOXYSILYL-CONTAINING THIOCARBOXYLIC ACID ESTERS Momentive Performance Materials Inc. (US) 2022-03-09 EP claimed
US-10919920-B2 Method for the manufacture of alkoxysilyl-containing thiocarboxylic acid esters MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2021-02-16 US claimed
WO-2020223068-A1 METHOD FOR THE MANUFACTURE OF ALKOXYSILYL-CONTAINING THIOCARBOXYLIC ACID ESTERS MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2020-11-05 WO claimed
US-20200347084-A1 METHOD FOR THE MANUFACTURE OF ALKOXYSILYL-CONTAINING THIOCARBOXYLIC ACID ESTERS MOMENTIVE PERFORMANCE MATERIALS INC. 2020-11-05 US claimed
CN-111170983-A Benzylthio acetamide compound and preparation method and application thereof 中国农业大学 2020-05-19 CN claimed
EP-1305015-B1 SUBSTITUTED STYRYL BENZYLSULFONES FOR TREATING PROLIFERATIVE DISORDERS UNIV TEMPLE (US) 2013-06-12 EP claimed
JP-4677162-B2 2011-04-27 JP claimed
US-20100152491-A1 PROCESSES FOR PREPARING (E)-STYRYLBENZYLSULFONE COMPOUNDS AND USES THEREOF FOR TREATING PROLIFERATIVE DISORDERS EPR PHARMACEUTICALS PVT.LTD 2010-06-17 US claimed
US-7732625-B2 Colorant compounds XEROX CORPORATION (US) 2010-06-08 US claimed
US-7311767-B2 Forming a salt of a liquid phase change ink carrier of stearyl stearamide, an amine substituted Xanthene, acridine, anthracene or thioxanthene chromogen, and a metal salt capable of forming a compound with two chromogens XEROX CORPORATION (US) 2007-12-25 US claimed
US-20050090690-A1 Process for preparing tetra-amide compounds XEROX CORPORATION 2005-04-28 US claimed
JP-2003530433-A 2003-10-14 JP claimed
EP-1305015-A4 SUBSTITUTED STYRYL BENZYLSULFONES FOR TREATING PROLIFERATIVE DISORDERS UNIV TEMPLE (US) 2003-05-21 EP claimed
EP-1305015-A1 SUBSTITUTED STYRYL BENZYLSULFONES FOR TREATING PROLIFERATIVE DISORDERS Temple University of the Commonwealth System of Higher Education (US) 2003-05-02 EP claimed
US-6486210-B2 SUCH AS ENANTIOMORPHS OF 4-FLUOROSTYRYL-2,3,4,5,6-PENTAFLUOROBENZYLSULFONE; ANTIPROLIFERATIVE/ANTICANCER AGENTS Temple University—Of the Commonwealth System of Higher Education 2002-11-26 US claimed
US-20020115643-A1 Substituted styryl benzylsulfones for treating proliferative disorders TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2002-08-22 US claimed
WO-2001078712-A1 SUBSTITUTED STYRYL BENZYLSULFONES FOR TREATING PROLIFERATIVE DISORDERS TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2001-10-25 WO claimed
EP-0494131-A1 Rubber compositions providing improved rubber-vulcanisate properties MONSANTO EUROPE S.A./N.V. (BE) 1992-07-08 EP claimed
EP-0158545-B1 [Alpha-(alkylaminomethyl)-benzylthio]-acetic-acid derivatives, process for their preparation and their therapeutic use LABORATOIRE L. LAFON Société anonyme dite: (FR) 1987-04-22 EP claimed
US-4177114-A PREPLATING, THIOCYANATE IONS HITACHI, LTD. (JP) 1979-12-04 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100152491-A1 PROCESSES FOR PREPARING (E)-STYRYLBENZYLSULFONE COMPOUNDS AND USES THEREOF FOR TREATING PROLIFERATIVE DISORDERS PCNA, CDC25B, CCNB1 CYP2C19 2225/4885HTT 3878/4885CYP1A2 2605/4885
US-20020115643-A1 Substituted styryl benzylsulfones for treating proliferative disorders HCCS, CCNO, HRAS CYP2C19 4680/4885HTT 3547/4885CYP1A2 4786/4885
US-10919920-B2 Method for the manufacture of alkoxysilyl-containing thiocarboxylic acid esters TST, MPST, APEH CYP2C19 2094/4885HTT 1300/4885CYP1A2 3615/4885
US-20050090690-A1 Process for preparing tetra-amide compounds TAF9, TAF5, TAF1 CYP2C19 1364/4885HTT 581/4885CYP1A2 968/4885
US-20200347084-A1 METHOD FOR THE MANUFACTURE OF ALKOXYSILYL-CONTAINING THIOCARBOXYLIC ACID ESTERS TST, MPST, APEH CYP2C19 2094/4885HTT 1300/4885CYP1A2 3615/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.