SCHEMBL65563

SCHEMBL65563

Cc1[c]c2ccccc2cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 8/20 0.37
TDP1 Q9NUW8 2/20 0.37
CYP1A2 P05177 4/20 0.34
TSHR P16473 4/20 0.34
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 2/20 0.33
ALOX12 P18054 1/20 0.33
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP1 P29466 1/20 0.31
RAB9A P51151 1/20 0.31
CASP7 P55210 1/20 0.31
ATM Q13315 1/20 0.31
HIF1A Q16665 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HPRT1 P00492 1/20 0.31
ACHE P22303 1/20 0.30

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
SCHEMBL5693005 1.00 CYP2A6 (0.37) CYP2A6TDP1CYP1A2TSHRALDH1A1
SCHEMBL328771 0.79 CYP2A6 (0.43) CYP2A6TDP1CYP1A2TSHRALDH1A1
SCHEMBL1557252 0.78 CYP2A6 (0.41) CYP2A6TDP1CYP1A2TSHRALDH1A1
SCHEMBL3112841 0.76 HPRT1 (0.50) CYP2A6TDP1CYP1A2TSHRALDH1A1
SCHEMBL18317617 0.74 HPRT1 (0.54) CYP2A6TDP1CYP1A2TSHRALDH1A1
SCHEMBL239122 0.74 CYP2A6 (0.37) CYP2A6TDP1CYP1A2TSHRALDH1A1
SCHEMBL593462 0.73 CYP2A6 (0.48) CYP2A6TDP1CYP1A2ALDH1A1HSD17B10
SCHEMBL7622283 0.72 CYP2A6 (0.41) CYP2A6TDP1CYP1A2TSHRALDH1A1
SCHEMBL7789583 0.72 CYP2A6 (0.33) CYP2A6TDP1CYP1A2TSHRHSD17B10
SCHEMBL667256 0.71 CYP1A2 (0.52) 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

Appears in 9566 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116162193-B Cycloolefin copolymer, optical product and electronic device 歌尔光学科技有限公司 2024-05-24 CN claimed
US-11926746-B2 Active energy ray-curable ink and image recording method FUJIFILM CORPORATION (JP) 2024-03-12 US claimed
CN-114728520-B Active energy ray-curable ink and image recording method 富士胶片株式会社 2024-03-08 CN claimed
EP-4271423-A1 ANTIMICROBIAL COMPOUNDS BASED ON GLUCOHEPTONIC ACIDS AND THEIR SALTS Harcros Chemicals Inc. (US) 2023-11-08 EP claimed
EP-3688124-B1 ESTER COMPOUNDS, LUBRICATING OIL COMPOSITIONS CONTAINING SAME AND PROCESSES FOR MAKING SAME EXXONMOBIL CHEMICAL PATENTS INC (US) 2023-10-25 EP claimed
CN-116874438-A One-pot method for preparing polysubstituted 1,2, 3-triazole compound 大连理工大学 2023-10-13 CN claimed
WO-2023180219-A1 A METHOD FOR SYNTHESIS OF HALIDE SALTS SOLAVENI GMBH (DE) 2023-09-28 WO claimed
EP-4249468-A1 A METHOD FOR SYNTHESIS OF HALIDE SALTS Solaveni GmbH (DE) 2023-09-27 EP claimed
CN-113956208-B Aryl heterocyclic derivative and synthesis method thereof 郑州大学 2023-08-15 CN claimed
CN-116410239-A Heteroatom-containing metallocene compound and preparation method and application thereof 惠生(中国)投资有限公司 2023-07-11 CN claimed
US-4019893-A Herbicidal method using 2-sulfinyl or 2-sulfonyl pyridine N-oxide derivatives UNIROYAL INC. (US) 1977-04-26 US claimed
US-4002679-A Preparation of polybenzimidazoles THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 1977-01-11 US claimed
US-4001268-A SUBSTITUTED PHENYL-BENZIMIDAZO COMPOUNDS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 1977-01-04 US claimed
US-4000190-A FROM DIALKYL OR DIARYL DISULFIDES, PHOSPHORUS, AND PHOSPHORUS TRIHALIDE STAUFFER CHEMICAL COMPANY (US) 1976-12-28 US claimed
US-3988435-A DENTIFRICE LEVER BROTHERS COMPANY (US) 1976-10-26 US claimed
US-3968156-A Process for preparing alkyl-or arylphosphonothioic dihalides STAUFFER CHEMICAL COMPANY (US) 1976-07-06 US claimed
US-3968232-A INSECTICIDE, ACARICIDE, NEMATOCIDE, FUNGICIDE, BACTERICIDE BAYER AKTIENGESELLSCHAFT (DT) 1976-07-06 US claimed
US-3962323-A PHOSPHORUS TRIHALIDE STAUFFER CHEMICAL COMPANY (US) 1976-06-08 US claimed
US-3960542-A Herbicidal 2-sulfinyl and 2-sulfonyl pyridine N-oxide derivatives UNIROYAL INC. (US) 1976-06-01 US claimed
US-3930671-A Color former and pressure-sensitive copying paper FUJI PHOTO FILM CO., LTD. (JA) 1976-01-06 US claimed