SCHEMBL26213

SCHEMBL26213

[CH2]Cc1ccc2ccccc2c1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.60
CYP2A6 P11509 1/20 0.60
HTR2A P28223 1/20 0.50
HTR2C P28335 1/20 0.50
HTR2B P41595 1/20 0.50
MC5R P33032 3/20 0.47
MC4R P32245 2/20 0.47
SIGMAR1 Q99720 1/20 0.47
KMT2A Q03164 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46
MC3R P41968 1/20 0.44
ALOX5 P09917 1/20 0.44
PYCR1 P32322 1/20 0.43
MAPK1 P28482 1/20 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
SCHEMBL1611744 0.93 CYP1A2 (0.52) CYP1A2CYP2A6HTR2AHTR2CHTR2B
SCHEMBL1969835 0.82 ALDH1A1 (0.54) CYP1A2CYP2A6MC5RMAPK1
SCHEMBL128640 0.81 CYP1A2 (0.56) CYP1A2CYP2A6HTR2AHTR2CHTR2B
SCHEMBL27589015 0.80 ALOX5 (0.58) CYP1A2CYP2A6KMT2AALOX5
SCHEMBL130981 0.80 CYP1A2 (0.60) CYP1A2CYP2A6HTR2AHTR2CHTR2B
SCHEMBL1970394 0.79 ALDH1A1 (0.56) CYP1A2CYP2A6MC5RMAPK1
SCHEMBL6240981 0.79 CYP1A2 (0.65) CYP1A2CYP2A6HTR2AHTR2CHTR2B
SCHEMBL29560700 0.79 CYP1A2 (0.65) CYP1A2CYP2A6HTR2AHTR2CHTR2B
SCHEMBL2838141 0.79 CYP1A2 (0.65) CYP1A2CYP2A6HTR2AHTR2CHTR2B
SCHEMBL128560 0.78 SIGMAR1 (0.59) CYP1A2CYP2A6HTR2AHTR2CHTR2B

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 12876 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024102890-A2 AMINO ACID-BENZOIC ACID OLIGOMERS AND METHODS OF USE THEREOF FOR TREATING CANCER THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-05-16 WO claimed
EP-4361141-A1 PROTEIN DEGRADATION AGENT Suzhou Kintor Pharmaceuticals, Inc. (CN) 2024-05-01 EP claimed
CN-117545749-A Protein degradation agent 苏州开拓药业股份有限公司 2024-02-09 CN claimed
WO-2024027694-A1 PROTEIN DEGRADATION AGENT 苏州开拓药业股份有限公司 2024-02-08 WO claimed
WO-2023107630-A2 AMINO ALCOHOL COMPOUNDS AND USES THEREOF Kineta, Inc. (US) 2023-06-15 WO claimed
WO-2023023513-A9 STABILIZATION OF OLIGONUCLEOTIDE AND OLIGONUCLEOTIDE-PROTEIN COMPLEX USING ALKYLATED PHOSPHATE UNIVERSITY OF MASSACHUSETTS (US) 2023-06-01 WO claimed
WO-2023023513-A1 STABILIZATION OF OLIGONUCLEOTIDE AND OLIGONUCLEOTIDE-PROTEIN COMPLEX USING ALKYLATED PHOSPHATE UNIVERSITY OF MASSACHUSETTS (US) 2023-02-23 WO claimed
WO-2022268066-A1 PROTEIN DEGRADATION AGENT 苏州开拓药业股份有限公司 2022-12-29 WO claimed
CN-114181250-A Alkenyl phosphine compound and preparation method thereof 中国石油化工股份有限公司 2022-03-15 CN claimed
US-11187981-B2 Resist composition and method of forming resist pattern TOKYO OHKA KOGYO CO., LTD. (JP) 2021-11-30 US claimed
US-5096925-A N-substituted butyramide derivatives CIBA-GEIGY CORPORATION (US) 1992-03-17 US claimed
US-5075339-A Antiinflammatory agents, antiallergens DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1991-12-24 US claimed
WO-1991013082-A1 2-ARALKOXY AND 2-ALKOXY ADENOSINE DERIVATIVES AS CORONARY VASODILATORS AND ANTIHYPERTENSIVE AGENTS WHITBY RESEARCH, INC. (US) 1991-09-05 WO claimed
US-4948813-A Benzylketone phospholipase A2 inhibitors E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-08-14 US claimed
EP-0179487-B1 2-PHENYLPROPIONIC ACID ESTERS, METHOD FOR OPTICAL RESOLUTION THEREOF AND OPTICALLY ACTIVE SUBSTANCE THEREOF NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1988-08-10 EP claimed
US-4709082-A 2-phenylpropionic acid esters, method for optical resolution thereof and optically active substance thereof NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1987-11-24 US claimed
EP-0179487-A1 2-Phenylpropionic acid esters, method for optical resolution thereof and optically active substance thereof NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1986-04-30 EP claimed
US-RE31343-E STABILIZERS FOR POLYMERS CIBA-GEIGY CORPORATION (US) 1983-08-09 US claimed
US-RE31342-E STABILIZERS FOR POLYMERS CIBA-GEIGY CORPORATION (US) 1983-08-09 US claimed
US-3932393-A 3-Methylenecephalosporins and process for production thereof ELI LILLY AND COMPANY (US) 1976-01-13 US claimed