SCHEMBL42954

SCHEMBL42954

COc1cccc(CN)c1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.71
MAOB P27338 4/20 0.71
IDO1 P14902 2/20 0.66
AGXT P21549 2/20 0.66
AOC3 Q16853 1/20 0.58
CHRM2 P08172 1/20 0.56
CHRM1 P11229 1/20 0.56
CHRM3 P20309 1/20 0.56
LPO P22079 1/20 0.56
CMA1 P23946 1/20 0.55
ALDH1A1 P00352 1/20 0.54
CYP3A4 P08684 1/20 0.54
SIGMAR1 Q99720 1/20 0.53

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
SCHEMBL29947713 1.00 TAAR1 (0.71) TAAR1MAOBIDO1AGXTAOC3
Bromide SCHEMBL31513707 0.98 TAAR1 (0.69) TAAR1MAOBIDO1AGXTAOC3
Hydrochloric Acid SCHEMBL1275116 0.98 MAOB (0.72) TAAR1MAOBIDO1AGXTAOC3
SCHEMBL920587 0.92 MAOB (0.63) TAAR1MAOBIDO1AGXTAOC3
Hydrochloric Acid SCHEMBL18641342 0.91 MAOB (0.64) TAAR1MAOBIDO1AGXTAOC3
Hydrochloric Acid SCHEMBL18641293 0.91 MAOB (0.64) TAAR1MAOBIDO1AGXTAOC3
SCHEMBL921289 0.87 MAOB (0.61) TAAR1MAOBIDO1AGXTAOC3
Hydrochloric Acid SCHEMBL18641331 0.85 MAOB (0.62) TAAR1MAOBIDO1AGXTAOC3
Anisole SCHEMBL11636165 0.84 LOXL2 (0.64) TAAR1MAOBIDO1AGXTALDH1A1
SCHEMBL1680537 0.84 MAOB (1.00) TAAR1MAOBIDO1AGXT

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 3161 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119977906-A A-site cation-regulated halide perovskite, and preparation method and application thereof 西北大学 2025-05-13 CN claimed
CN-119140080-B Titanium oxide film catalytic material for rapid high-yield synthesis of imine and preparation method and application thereof 中国科学院理化技术研究所 2025-02-11 CN claimed
CN-119371674-A Preparation method of donor-acceptor type metal organic framework photocatalyst and application of photocatalytic amine oxide/thioether 长沙理工大学 2025-01-28 CN claimed
CN-119140080-A Titanium oxide film catalytic material for rapid high-yield synthesis of imine and preparation method and application thereof 中国科学院理化技术研究所 2024-12-17 CN claimed
CN-114751867-B Feed additive and preparation method and application thereof 重庆市万虹饲料有限公司 2024-09-06 CN claimed
US-12024483-B2 Synthesis method of hydroxybenzylamine TAIZHOU CHUANGYUAN INDUSTRIAL TECHNOLOGY CO., LTD (CN) 2024-07-02 US claimed
CN-117983246-A Supported Ag-Cu nanocluster catalyst and application thereof in catalyzing oxidative coupling reaction of benzylamine 安徽大学 2024-05-07 CN claimed
CN-117924210-A Preparation method of 2-iminothiazolidine-4-ketone compound 赣南师范大学 2024-04-26 CN claimed
CN-114651898-B Triazole feed additive for improving immunity as well as preparation method and application thereof 天津溢佳同惠科技集团有限公司 2024-04-05 CN claimed
CN-116082232-A Monoamine oxidase inhibitor, preparation method and application thereof 浙江海洋大学 2023-05-09 CN claimed
WO-1999055679-A1 ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME TREGA BIOSCIENCES, INC. (US) 1999-11-04 WO claimed
EP-0635508-B1 TETRAHYDROPYRIDINE DERIVATIVE HAVING SUBSTITUENTS ON THREE RINGS ASAHI CHEMICAL IND (JP) 1999-10-06 EP claimed
EP-0810991-B1 1-ARYL-2-ACYLAMINO-ETHANE COMPOUNDS AND THEIR USE AS NEUROKININ ESPECIALLY NEUROKININ 1 ANTAGONISTS NOVARTIS AG (CH) 1999-04-14 EP claimed
US-5853933-A Photoconductive member and perylene processes XEROX CORPORATION (US) 1998-12-29 US claimed
US-5663022-A Recording sheets XEROX CORPORATION (US) 1997-09-02 US claimed
US-5621103-A 3-(SUBSTITUTED METHYLAMINOCARBONYL)-1,2,3,4-TETRAHYDRO-(1)BENZOTHIENO(2,3-C) PYRIDINES; ANXIOLYTIC AGENTS; LEARNING ENHANCEMENT ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1997-04-15 US claimed
EP-0674232-A2 Recording sheets XEROX CORPORATION (US) 1995-09-27 EP claimed
US-5427888-A Positive photosensitive resin composition comprising a polymer having carbon-carbon double bonds, a maleic acid group and a maleimide group NIPPON OIL CO., LTD. (JP) 1995-06-27 US claimed
US-5411836-A Positive type photoresist composition comprising a polymer having carbon-carbon double bonds with a maleic half ester and a maleimide attached to the backbone NIPPON OIL CO., LTD. (JP) 1995-05-02 US claimed
EP-0635508-A1 TETRAHYDROPYRIDINE DERIVATIVE HAVING SUBSTITUENTS ON THREE RINGS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1995-01-25 EP claimed