SCHEMBL913100

SCHEMBL913100

CC(SOSC(C)c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TAAR1 Q96RJ0 4/20 0.39
CYP2D6 P10635 2/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2C P18825 1/20 0.38
LMNA P02545 1/20 0.38
HIF1A Q16665 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.37
DPP4 P27487 2/20 0.36
TSHR P16473 2/20 0.36
F2 P00734 1/20 0.36
HRH1 P35367 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
SLC6A4 P31645 1/20 0.35
CYP2C19 P33261 1/20 0.35
SLC6A3 Q01959 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
SCHEMBL8768557 0.76 KMT2A (0.42) KMT2ACYP2D6LMNAALDH1A1CYP3A4
SCHEMBL775627 0.76 KMT2A (0.45) KMT2AL3MBTL1TAAR1CYP2D6ADRA2A
SCHEMBL577805 0.76 ALDH1A1 (0.46) KMT2AL3MBTL1TAAR1CYP2D6ADRA2A
SCHEMBL9281233 0.75 MIF (0.36) KMT2ATAAR1CYP2D6ADRA2AADRA2C
SCHEMBL30295822 0.74 CYP3A4 (0.43) KMT2ACYP2D6LMNAALDH1A1CYP3A4
SCHEMBL20809867 0.74 KMT2A (0.44) KMT2AL3MBTL1TAAR1CYP2D6ADRA2A
SCHEMBL1145689 0.74 KMT2A (0.44) KMT2AL3MBTL1TAAR1CYP2D6ADRA2A
SCHEMBL2874877 0.74 TSHR (0.43) L3MBTL1TAAR1CYP2D6DPP4TSHR
SCHEMBL14535430 0.74 KMT2A (0.44) KMT2AL3MBTL1TAAR1CYP2D6ADRA2A
SCHEMBL5075498 0.73 KMT2A (0.42) KMT2AL3MBTL1CYP2D6ADRA2AADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104267578-B A kind of sulfosalt class photo-acid agent containing fluorenes, preparation method and applications 同济大学 2017-12-05 CN claimed
CN-105153330-B The double-branched light-sensitive compound of one class biphenyl type, preparation method and applications 同济大学 2017-04-05 CN claimed
CN-104610263-B Chiral imidazolidinone-phenol 成都理工大学 2016-06-29 CN claimed
CN-104610263-A Chiral imidazolinone-phenol UNIV CHENGDU TECHNOLOGY 2015-05-13 CN claimed
CN-101372676-B A strain of Rhodococcus and use thereof for preparing optical pure chiral sulphoxide UNIV EAST CHINA SCIENCE & TECH 2010-08-18 CN claimed
CN-101372676-A A strain of Rhodococcus and use thereof for preparing optical pure chiral sulphoxide UNIV EAST CHINA SCIENCE & TECH (CN) 2009-02-25 CN claimed
CN-108103522-B A kind of method that electro-catalysis thioether molecule oxygen aoxidizes sulfoxide and sulfone compound processed 三峡大学 2019-09-24 CN disclosed
CN-107001883-B Hot melt adhesive for woodwork 出光兴产株式会社 2019-08-27 CN disclosed
CN-105358602-B modified resin and resin composition 旭化成株式会社 2018-12-04 CN disclosed
CN-108103522-A A kind of method that electro-catalysis thioether molecule oxygen aoxidizes sulfoxide and sulfone compound processed 三峡大学 2018-06-01 CN disclosed
CN-108091826-A Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same 三菱化学株式会社 2018-05-29 CN disclosed
CN-107983408-A It is a kind of to prepare sulfoxide type catalyst and its selective method for preparing sulfoxide compound 三峡大学 2018-05-04 CN disclosed
CN-105481739-B (phenylethyl thioether) the epoxide benzophenone of 2 hydroxyl 4 and its synthetic method 上海东升新材料有限公司 2018-03-09 CN disclosed
CN-1321951-C Process for preparing fluorinated organic compounds and fluorinating agent DAIKIN IND LTD (JP) 2007-06-20 CN disclosed
CN-1214049-C Process for producing ethylene/olefin interpolymers EASTMAN CHEM CO (US) 2005-08-10 CN disclosed
CN-1367798-A Process for producing ethylene/olefin interpolymers EASTMAN CHEM CO (US) 2002-09-04 CN disclosed
EP-1204644-A1 SYNTHESIS OF SUBSTITUTED AMIDINES ELI LILLY AND COMPANY (US) 2002-05-15 EP disclosed
WO-2000078725-A1 SYNTHESIS OF SUBSTITUTED AMIDINES ELI LILLY AND COMPANY (US) 2000-12-28 WO disclosed
CN-1042429-C Pyrimidinedione derivative used as antitumor drug, pharmaceutical composition and preparation method MERRELL PHARMA INC (US) 1999-03-10 CN disclosed
CN-1130909-A 5-(1-fluoro-vinyl)-1H-pyrimidine-2,4-dione derivatives useful as antineoplastic agents MERRELL DOW PHARMA (US) 1996-09-11 CN disclosed