SCHEMBL167213

SCHEMBL167213

Cc1ccc2cc3ccccc3cc2c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 8/20 0.84
TDP1 Q9NUW8 2/20 0.84
CYP1A2 P05177 10/20 0.72
ALDH1A1 P00352 5/20 0.50
HSD17B10 Q99714 3/20 0.50
CYP3A4 P08684 2/20 0.50
ALOX15 P16050 1/20 0.50
CASP1 P29466 1/20 0.50
CASP7 P55210 1/20 0.50
HBB P68871 1/20 0.50
HIF1A Q16665 1/20 0.50
NQO2 P16083 1/20 0.46
ACHE P22303 1/20 0.43
HPGD P15428 2/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NCK1 P16333 1/20 0.41
BACE1 P56817 1/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL6889849 1.00 CYP2A6 (0.84) CYP2A6TDP1CYP1A2ALDH1A1HSD17B10
SCHEMBL890049 1.00 CYP2A6 (0.84) CYP2A6TDP1CYP1A2ALDH1A1HSD17B10
SCHEMBL1310563 1.00 CYP2A6 (0.84) CYP2A6TDP1CYP1A2ALDH1A1HSD17B10
SCHEMBL36453 0.92 CYP2A6 (1.00) CYP2A6TDP1CYP1A2ALDH1A1HSD17B10
SCHEMBL28081333 0.92 CYP2A6 (1.00) CYP2A6TDP1CYP1A2ALDH1A1HSD17B10
SCHEMBL29372904 0.92 CYP2A6 (1.00) CYP2A6TDP1CYP1A2ALDH1A1HSD17B10
SCHEMBL2490023 0.91 CYP1A2 (0.87) CYP2A6TDP1CYP1A2ALDH1A1HSD17B10
SCHEMBL2463834 0.91 CYP1A2 (0.87) CYP2A6TDP1CYP1A2ALDH1A1HSD17B10
SCHEMBL6888140 0.91 CYP1A2 (0.87) CYP2A6TDP1CYP1A2ALDH1A1HSD17B10
SCHEMBL6056946 0.91 CYP1A2 (0.87) CYP2A6TDP1CYP1A2ALDH1A1HSD17B10

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 1518 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024002966-A1 HYDROPHILIC PHENALENONES AND THEIR USE IN ANTIMICROBIAL PHOTODYNAMIC THERAPY CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2024-01-04 WO claimed
EP-4299131-A1 HYDROPHILIC PHENALENONES AND THEIR USE IN ANTIMICROBIAL PHOTODYNAMIC THERAPY Centre national de la recherche scientifique (FR) 2024-01-03 EP claimed
WO-2022203320-A1 PATTERNED ORGANIC THIN FILM DEPOSITION APPARATUS AND METHOD FOR MANUFACTURING DISPLAY DEVICE USING SAME 주식회사 유니텍스 2022-09-29 WO claimed
CN-112851893-B Irradiation crosslinking polyethylene foam material and preparation method thereof 浙江万里新材料科技有限公司 2022-09-02 CN claimed
WO-2022173220-A1 PATTERNED THIN FILM FORMING METHOD AND DEVICE MANUFACTURING METHOD USING SAME 주식회사 유니텍스 2022-08-18 WO claimed
CN-108560082-B Preparation method of high-strength coal-based isotropic pitch-based carbon fiber HUNAN UNIVERSITY (CN) 2021-06-22 CN claimed
CN-112851893-A Irradiation crosslinking polyethylene foam material and preparation method thereof 浙江万里新材料科技有限公司 2021-05-28 CN claimed
CN-111999409-A Fingerprint identification method for heavy fuel oil and crude oil of ship 中国科学院烟台海岸带研究所 2020-11-27 CN claimed
CN-107148497-B Additive for electrodeposition 思力柯集团 2019-12-17 CN claimed
CN-109644812-A The easy method for quickly removing butt 中国林业科学研究院亚热带林业研究所 2019-04-19 CN claimed
US-5494618-A POLYMERIZING VINYL ETHER AND EPOXIDES USING ANTHRACENE OR COMPOUNDS AS ULTRAVIOLET LIGHT ABSORBERS, AND ONIUM SALT AS PHOTOINITIATOR ALLIEDSIGNAL INC. (US) 1996-02-27 US claimed
EP-0325061-B1 Process for producing poly (para-phenylene-sulfide) TOSOH CORP (JP) 1995-12-06 EP claimed
EP-0404466-B1 Biological remediation of creosote- and similarly-contaminated sites US ENVIRONMENT (US) 1994-09-21 EP claimed
WO-1992013953-A1 MICROBIAL TRANSFORMATION OF RECALCITRANT PCB COMPOUNDS SBP TECHNOLOGIES, INC. (US) 1992-08-20 WO claimed
WO-1992012248-A1 BIOLOGICAL REMEDIATION OF CREOSOTE AND SIMILARLY-CONTAMINATED SITES SBP TECHNOLOGIES, INC. (US) 1992-07-23 WO claimed
US-5132224-A Biodegradation with Pseudomonas THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE U.S. ENVIRONMENTAL PROTECTION AGENCY (US) 1992-07-21 US claimed
US-5073655-A Alkylation of aromatic hydrocarbon with aromatic alklating hal ide, alcohol or olefin, a mixed oxide of silica or germania wi th alumina, boria, iron oxide or gallium oxide MOBIL OIL CORP. (US) 1991-12-17 US claimed
EP-0404466-A1 Biological remediation of creosote- and similarly-contaminated sites UNITED STATES ENVIRONMENTAL PROTECTION AGENCY (US) 1990-12-27 EP claimed
US-4438037-A ANTHRAQUINONES FROM ANTHRACENES ICI AMERICAS INC. (US) 1984-03-20 US claimed
US-3971810-A Solid pesticidal chlorinated phenolic concentrates PHILLIPS PETROLEUM COMPANY (US) 1976-07-27 US claimed