SCHEMBL657897

SCHEMBL657897

Cc1ccc(S(=O)(=O)O)cc1.Cc1ccc(S(=O)(=O)O)cc1.OC1CCC(O)CC1

nearest known ligand 0.54

Known targets — ChEMBL curated mechanism

ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.54
ALDH1A1 P00352 4/20 0.47
LMNA P02545 2/20 0.47
HTT P42858 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
GAA P10253 1/20 0.46
SNCA P37840 1/20 0.45
PKM P14618 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
MMP1 P03956 1/20 0.44
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP8 P22894 1/20 0.44
MMP13 P45452 1/20 0.44
TSHR P16473 2/20 0.43

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
Cyclopentanol SCHEMBL1554394 0.92 CYP2D6 (0.51) CYP2D6ALDH1A1LMNAHTTKDM4E
Cyclohexanol SCHEMBL1553521 0.91 ALDH1A1 (0.51) CYP2D6ALDH1A1LMNAHTTKDM4E
SCHEMBL10762325 0.88 CYP2D6 (0.46) CYP2D6ALDH1A1LMNAHTTKDM4E
SCHEMBL10409068 0.88 CYP2D6 (0.46) CYP2D6ALDH1A1LMNAHTTKDM4E
SCHEMBL2489459 0.86 CYP2D6 (0.55) CYP2D6ALDH1A1LMNAHTTKDM4E
SCHEMBL1705904 0.85 GAA (0.62) CYP2D6ALDH1A1LMNAHTTKDM4E
SCHEMBL34 0.85 GAA (0.62) CYP2D6ALDH1A1LMNAHTTKDM4E
SCHEMBL31313 0.85 GAA (0.62) CYP2D6ALDH1A1LMNAHTTKDM4E
SCHEMBL5068661 0.85 GAA (0.62) CYP2D6ALDH1A1LMNAHTTKDM4E
SCHEMBL11432043 0.85 GAA (0.62) CYP2D6ALDH1A1LMNAHTTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115482716-A Tamper-proof certificate card containing holographic anti-counterfeiting mark and manufacturing method thereof 深圳市深大极光科技有限公司 2022-12-16 CN disclosed
US-11450445-B2 Electroconductive film and method for manufacturing electroconductive pattern TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2022-09-20 US disclosed
CN-114179549-A Anti-fake certificate card with anti-fake mark and its making process 公安部交通管理科学研究所 2022-03-15 CN disclosed
US-20200303086-A1 ELECTROCONDUCTIVE FILM AND METHOD FOR MANUFACTURING ELECTROCONDUCTIVE PATTERN TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2020-09-24 US disclosed
US-10720259-B2 Electroconductive film and method for manufacturing electroconductive pattern TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2020-07-21 US disclosed
US-9982157-B2 Aqueous laser-sensitive composition for marking substrates DATALASE LTD. (GB) 2018-05-29 US disclosed
US-20170309363-A1 ELECTROCONDUCTIVE FILM AND METHOD FOR MANUFACTURING ELECTROCONDUCTIVE PATTERN TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2017-10-26 US disclosed
US-9333786-B2 Laser-sensitive coating formulations DATALASE, LTD. (GB) 2016-05-10 US disclosed
US-9267042-B2 Coating composition for marking substrates DATALASE LTD. (GB) 2016-02-23 US disclosed
US-20150361289-A1 AQUEOUS LASER-SENSITIVE COMPOSITION FOR MARKING SUBSTRATES DATALASE LTD. (GB) 2015-12-17 US disclosed
US-20120045624-A1 AQUEOUS LASER-SENSITIVE COMPOSITION FOR MARKING SUBSTRATES BASF SE (DE) 2012-02-23 US disclosed
US-20110274893-A1 COATING COMPOSITION FOR MARKING SUBSTRATES BASF SE (DE) 2011-11-10 US disclosed
US-8021820-B2 Coating composition for marking substrates DATALASE LTD. (GB) 2011-09-20 US disclosed
US-20100233447-A1 LASER-SENSITIVE COATING FORMULATIONS CIBA CORPORATION (US) 2010-09-16 US disclosed
US-20090191420-A1 Coating Composition for Marking Substrates CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2009-07-30 US disclosed