SCHEMBL1629684

SCHEMBL1629684

CCCOC(=O)c1ccccc1C

nearest known ligand 0.79

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.79
TSHR P16473 6/20 0.62
L3MBTL1 Q9Y468 3/20 0.62
TDP1 Q9NUW8 2/20 0.62
CYP3A4 P08684 2/20 0.61
MAPK1 P28482 2/20 0.61
TP53 P04637 1/20 0.61
LMNA P02545 2/20 0.59
HSD17B10 Q99714 4/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
KDM4E B2RXH2 3/20 0.51
POLB P06746 1/20 0.51
ADRB2 P07550 2/20 0.50
ADRB1 P08588 2/20 0.50
ADRB3 P13945 2/20 0.50
MAOB P27338 1/20 0.50
NPC1 O15118 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
Alcohol SCHEMBL27463083 0.96 ALDH1A1 (0.73) ALDH1A1TSHRL3MBTL1TDP1CYP3A4
SCHEMBL17797782 0.90 TSHR (0.66) ALDH1A1TSHRL3MBTL1TDP1CYP3A4
SCHEMBL18499669 0.90 ALDH1A1 (0.64) ALDH1A1TSHRL3MBTL1TDP1CYP3A4
SCHEMBL29822410 0.90 ALDH1A1 (0.64) ALDH1A1TSHRL3MBTL1TDP1CYP3A4
SCHEMBL6057039 0.89 TSHR (0.80) ALDH1A1TSHRL3MBTL1TDP1CYP3A4
SCHEMBL112063 0.88 ALDH1A1 (1.00) ALDH1A1TSHRL3MBTL1TDP1CYP3A4
SCHEMBL19066309 0.88 ALDH1A1 (1.00) ALDH1A1TSHRL3MBTL1TDP1CYP3A4
SCHEMBL8661935 0.88 TSHR (0.81) ALDH1A1TSHRL3MBTL1TDP1CYP3A4
SCHEMBL28020077 0.88 ALDH1A1 (0.61) ALDH1A1TSHRL3MBTL1TDP1CYP3A4
SCHEMBL14984028 0.87 TSHR (0.68) ALDH1A1TSHRL3MBTL1TDP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106187778-B A method of processing o-Xylene Oxidation in Liquid Phase residue 中国科学院大连化学物理研究所 2019-04-23 CN claimed
CN-106187766-B A kind of processing method of o-Xylene Oxidation in Liquid Phase residue 中国科学院大连化学物理研究所 2019-04-23 CN claimed
CN-106187766-A A kind of processing method of o-Xylene Oxidation in Liquid Phase residue 中国科学院大连化学物理研究所 2016-12-07 CN claimed
CN-101781377-B Initiation system for preparing high-reactivity polyisobutene UNIV BEIJING CHEMICAL 2011-07-20 CN claimed
CN-101781377-A Initiation system for preparing high-reactivity polyisobutene UNIV BEIJING CHEMICAL 2010-07-21 CN claimed
CN-1176123-C Initiation system for preparing polyisobutene with reactive activity 北京化工大学 2004-11-17 CN claimed
CN-1417234-A Cation Polymerization process of preparing isoolefine polymer or copolymer CHINA PETROCHEMICAL CORP (CN) 2003-05-14 CN claimed
CN-1323841-A Initiation system for preparing polyisobutene with reactive activity UNIV BEIJING CHEMICAL ENG (CN) 2001-11-28 CN claimed
US-20250066515-A1 METHOD FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, METHOD FOR PRODUCING CATALYST FOR OLEFIN POLYMERIZATION, AND METHOD FOR PRODUCING OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2025-02-27 US disclosed
US-12234312-B2 Solid catalyst component for olefin polymerization SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2025-02-25 US disclosed
CN-115448920-B Beta-lactamase inhibitor and application thereof 广州楷石医药有限公司 2025-01-03 CN disclosed
US-12173107-B2 Solid catalyst component for olefin polymerization SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2024-12-24 US disclosed
CN-119161509-A Solid catalyst component for olefin polymerization 住友化学株式会社 2024-12-20 CN disclosed
CN-114057913-B Solid catalyst component for olefin polymerization 住友化学株式会社 2024-10-11 CN disclosed
EP-0023885-A1 Method for the introduction of an oxygen-containing functional group into ansamycines, compounds thus obtained, and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1981-02-11 EP disclosed
US-4145344-A BICYCLOMYCIN DERIVATIVES CIBA-GEIGY CORPORATION (US) 1979-03-20 US disclosed
US-4144228-A Methionine5 -enkephalin sulfoxides and sulfones G. D. SEARLE & CO. (US) 1979-03-13 US disclosed
US-4092304-A OLIGOPEPTIDE; ANALGESICS, ANTIDIARRHEAL AGENTS, NON-ADDICTING NARCOTIC ANTAGONISTS G. D. SEARLE & CO. (US) 1978-05-30 US disclosed
US-4028319-A 2 AND 3-SUBSTITUTED ENKEPHALINS G. D. SEARLE & CO. (US) 1977-06-07 US disclosed
US-4012367-A Anti-ulcer polypeptides containing L-aspartic acid and intermediates thereto G. D. SEARLE & CO. (US) 1977-03-15 US disclosed