SCHEMBL3669724

SCHEMBL3669724

O=S1(=O)c2ccc(O)cc2-c2cc(Br)ccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.41
MCL1 Q07820 1/20 0.41
ALOX15 P16050 3/20 0.41
ESR1 P03372 4/20 0.40
ESR2 Q92731 4/20 0.40
S100A4 P26447 1/20 0.39
MAOA P21397 1/20 0.39
UGT1A1 P22309 1/20 0.39
MAOB P27338 1/20 0.39
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
GPR3 P46089 1/20 0.37
NFKBIA P25963 1/20 0.36
RELA Q04206 1/20 0.36
CTSL P07711 1/20 0.35
CES2 O00748 1/20 0.35
GALR3 O60755 1/20 0.35

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
SCHEMBL29697204 0.89 S100A4 (0.46) BCL2MCL1S100A4CA1CA2
SCHEMBL1798819 0.89 S100A4 (0.46) BCL2MCL1S100A4CA1CA2
SCHEMBL21832063 0.82 S100A4 (0.45) BCL2MCL1S100A4CA1CA2
SCHEMBL27373014 0.80 GPR3 (0.64) ESR1ESR2MAOAGPR3
SCHEMBL30481783 0.80 GPR3 (0.64) MAOACA9GPR3CYP1A2
SCHEMBL17322541 0.80 GPR3 (0.64) MAOACA9GPR3CYP1A2
SCHEMBL18267527 0.79 S100A4 (0.52) BCL2MCL1S100A4MAOACA1
SCHEMBL17739631 0.74 MAPK1 (0.47) MCL1MAOAMAOBGPR3RELA
SCHEMBL25989622 0.74 CHRNA1 (0.45) BCL2MCL1S100A4CA1CA2
SCHEMBL20389951 0.73 S100A4 (0.50) BCL2MCL1S100A4MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2190832-A2 SELENOPHENES AND SELENOPHENE-BASED POLYMERS, THEIR PREPARATION AND USES THEREOF Yeda Research And Development Co. Ltd. (IL) 2010-06-02 EP disclosed
WO-2009034571-A2 SELENOPHENES AND SELENOPHENE-BASED POLYMERS, THEIR PREPARATION AND USES THEREOF YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2009-03-19 WO disclosed
CN-1024067-C Use of electrically conductive substituted polyisothianaphthenes UNIV CALIFORNIA (US) 1994-03-16 CN disclosed
EP-0273643-B1 Conducting substituted polyisothianophthenes UNIV CALIFORNIA (US) 1994-01-26 EP disclosed
CN-1023527-C Rechargeable battery electrode and high molecular weight conductive film UNIV CALIFORNIA (US) 1994-01-12 CN disclosed
CN-1018874-B POLYMER HAVING ISOTHIANAPHTHENE STRUCTURE AND ELECTROCHROMIC DISPLAY UNIV CALIFORNIA (US) 1992-10-28 CN disclosed
CN-1062148-A Conduction be with substituent polyisothianaphthene class UNIV CALIFORNIA (US) 1992-06-24 CN disclosed
CN-1015628-B Process for preparing electrically conductive substituted polyisothianaphthenes UNIV CALIFORNIA (US) 1992-02-26 CN disclosed
CN-1045410-A Preparation method with polymkeric substance of indene structure different sulfur and electrochromism demonstration UNIV CALIFORNIA (US) 1990-09-19 CN disclosed
EP-0164974-B1 POLYMER HAVING ISOTHIANAPHTHENE STRUCTURE AND ELECTROCHROMIC DISPLAY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1990-05-23 EP disclosed
CN-1007815-B Preparation method of polymer with isothianaphthene structure and electrochromic display UNIV CALIFORNIA (US) 1990-05-02 CN disclosed
US-4795242-A ELECTROCONDUCTIVITY UNIVERSITY OF CALIFORNIA (US) 1989-01-03 US disclosed
US-4772940-A Polymer having isothianaphthene structure and electrochromic display REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1988-09-20 US disclosed
CN-87108150-A Conductive substituted polyisothianaphthenes 1988-08-31 CN disclosed
EP-0273643-A2 Conducting substituted polyisothianophthenes THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1988-07-06 EP disclosed
CN-85105974-A Preparation method of polymer with isothianaphthene structure and electrochromic display 1987-02-04 CN disclosed
US-4640748-A Polyisothianaphtene, a new conducting polymer THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1987-02-03 US disclosed
EP-0164974-A2 Polymer having isothianaphthene structure and electrochromic display THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1985-12-18 EP disclosed