SCHEMBL92174

SCHEMBL92174

COc1cc(C)ccc1C

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.68
ALDH1A1 P00352 5/20 0.54
CYP3A4 P08684 1/20 0.54
GAA P10253 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
CYP2C9 P11712 2/20 0.46
MAPT P10636 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
TSHR P16473 1/20 0.46
MEN1 O00255 1/20 0.46
USP2 O75604 1/20 0.46
POLB P06746 1/20 0.46
HPGD P15428 1/20 0.46
ALOX12 P18054 1/20 0.46
MAPK1 P28482 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44

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
SCHEMBL30167567 1.00 ACHE (0.68) ACHEALDH1A1CYP3A4GAATDP1
Ammonia Solution, Strong SCHEMBL27939388 0.97 ACHE (0.65) ACHEALDH1A1CYP3A4GAATDP1
Formaldehyde SCHEMBL27962744 0.93 ACHE (0.60) ACHEALDH1A1CYP3A4GAATDP1
SCHEMBL29216678 0.91 ACHE (0.64) ACHEALDH1A1CYP3A4GAATDP1
SCHEMBL6452732 0.85 ACHE (0.52) ACHEALDH1A1CYP3A4GAATDP1
O-Xylene SCHEMBL5673863 0.82 ACHE (0.54) ACHEALDH1A1CYP3A4GAATDP1
Anisole SCHEMBL5671782 0.82 CA4 (0.50) ACHEALDH1A1CYP3A4GAATDP1
SCHEMBL13335119 0.81 ALDH1A1 (0.48) ACHEALDH1A1CYP3A4TDP1TSHR
SCHEMBL29403877 0.81 ACHE (1.00) ACHEALDH1A1CYP3A4GAATDP1
SCHEMBL12518 0.81 ACHE (1.00) ACHEALDH1A1CYP3A4GAATDP1

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 2387 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120040272-A Method for producing m-ethyl anisole and p-ethyl anisole by using xylenol oil 煤炭科学技术研究院有限公司 2025-05-27 CN claimed
CN-116789771-B Antibacterial polypeptide modified protein derivative and preparation method and application thereof 南京杰肽生物科技有限公司 2023-11-14 CN claimed
CN-109516923-A Compounds and organic luminescent device comprising it 东进世美肯株式会社 2019-03-26 CN claimed
US-10224485-B2 Process for preparing a crystalline organic semiconductor material BASF SE (DE) 2019-03-05 US claimed
EP-1891180-B1 ORGANIC SEMICONDUCTOR SOLUTIONS MERCK PATENT GMBH (DE) 2018-08-29 EP claimed
EP-1716604-B1 SOLUTIONS OF ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2017-07-26 EP claimed
US-20160329510-A1 PHOTOVOLTAIC CELLS MERCK PATENT GMBH (DE) 2016-11-10 US claimed
CN-105849931-A Photovoltaic cell 默克专利有限公司 2016-08-10 CN claimed
US-9293711-B2 Organic semiconductor formulations POLYERA CORPORATION (US) 2016-03-22 US claimed
EP-1745520-B1 SOLUTIONS OF ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2015-10-21 EP claimed
US-5726343-A REACTION OF A BORONIC ACID COMPOUND WITH A METHOXYIMINOACETIC ESTER, INSECTICIDES, MICROBIOCIDES NOVARTIS CORPORATION (US) 1998-03-10 US claimed
EP-0547825-B1 Process for producing alpha-ketoamide derivative SHIONOGI & CO (JP) 1997-09-03 EP claimed
EP-0741693-A1 PROCESS FOR THE PREPARATION OF ARYLACETIC ESTER DERIVATIVES VIA PALLADIUM-CATALYZED CROSS COUPLING REACTION Novartis AG (CH) 1996-11-13 EP claimed
WO-1995020569-A1 PROCESS FOR THE PREPARATION OF ARYLACETIC ESTER DERIVATIVES VIA PALLADIUM-CATALYZED CROSS COUPLING REACTION CIBA-GEIGY AG (CH) 1995-08-03 WO claimed
US-5414122-A Process for producing alpha-ketoamide derivative SHIONOGI & CO., LTD. (JP) 1995-05-09 US claimed
US-5258551-A Amidation of benzoyl halide derivative with organic isocyanide; fungicide intermediates SHIONOGI & CO., LTD. (JP) 1993-11-02 US claimed
EP-0547825-A2 Process for producing alpha-ketoamide derivative SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) 1993-06-23 EP claimed
US-4707161-A Lightfastness of dyeings obtained with acid dyes or metal complex dyes on polyamides: treatment with copper hydroxamates BASF AKTIENGESELLSCHAFT (DE) 1987-11-17 US claimed
US-4493904-A COORDINATION, POLYMERIZATION CATALYST CONTAINING TITANIUM TRICHORI CONOCO INC. (US) 1985-01-15 US claimed
US-4473713-A Hydrolysis of aryl-aliphatic ethers RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1984-09-25 US claimed