SCHEMBL39970

SCHEMBL39970

COc1ccccc1CN

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.69
IDO1 P14902 2/20 0.63
ALDH1A1 P00352 2/20 0.59
GAA P10253 1/20 0.59
MAPT P10636 1/20 0.59
CHRM2 P08172 4/20 0.55
CHRM1 P11229 1/20 0.55
AOC3 Q16853 1/20 0.55
CA1 P00915 3/20 0.55
CA2 P00918 3/20 0.55
CA9 Q16790 3/20 0.55
CA7 P43166 2/20 0.55
CA12 O43570 2/20 0.55
CA14 Q9ULX7 2/20 0.55
CA4 P22748 1/20 0.55
LMNA P02545 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
SIGMAR1 Q99720 1/20 0.50
ADRA2B P18089 1/20 0.50
PTGS1 P23219 1/20 0.50

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
SCHEMBL29633165 1.00 TAAR1 (0.69) TAAR1IDO1ALDH1A1GAAMAPT
Hydrochloric Acid SCHEMBL9272901 0.98 TAAR1 (0.67) TAAR1IDO1ALDH1A1GAAMAPT
Hydrochloric Acid SCHEMBL27527127 0.98 TAAR1 (0.67) TAAR1IDO1ALDH1A1GAAMAPT
Ammonia Solution, Strong SCHEMBL7689341 0.98 TAAR1 (0.67) TAAR1IDO1ALDH1A1GAAMAPT
SCHEMBL2782786 0.90 TAAR1 (0.58) TAAR1IDO1ALDH1A1GAAMAPT
Toluene SCHEMBL28863023 0.90 TAAR1 (0.58) TAAR1IDO1ALDH1A1GAAMAPT
Aniline SCHEMBL22169202 0.90 TAAR1 (0.58) TAAR1IDO1ALDH1A1GAAMAPT
Acetonitrile SCHEMBL3928449 0.90 TAAR1 (0.58) TAAR1IDO1ALDH1A1GAAMAPT
SCHEMBL8356887 0.88 TAAR1 (0.56) TAAR1IDO1ALDH1A1GAAMAPT
SCHEMBL3866915 0.88 TAAR1 (0.61) TAAR1IDO1ALDH1A1GAAMAPT

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 3267 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
US-20250145472-A1 METHOD FOR GENERATING CARBON DIOXIDE KOBE GAKUIN EDUCATIONAL FOUNDATION (JP) 2025-05-08 US 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
EP-4480568-A1 METHOD FOR GENERATING CARBON DIOXIDE Kobe Gakuin Educational Foundation (JP) 2024-12-25 EP 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-118440012-A Preparation method of quinazoline compound 安顺学院 2024-08-06 CN claimed
US-12024483-B2 Synthesis method of hydroxybenzylamine TAIZHOU CHUANGYUAN INDUSTRIAL TECHNOLOGY CO., LTD (CN) 2024-07-02 US claimed
WO-2023153506-A1 METHOD FOR GENERATING CARBON DIOXIDE 学校法人神戸学院 2023-08-17 WO claimed
US-20220289664-A1 SYNTHESIS METHOD OF HYDROXYBENZYLAMINE TAIZHOU CHUANGYUAN INDUSTRIAL TECHNOLOGY CO., LTD (CN) 2022-09-15 US claimed
EP-0808303-A1 5-(4-SUBST.-PIPERIDINYL-1)-3-ARYL-PENTANOIC ACID DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONIST ZENECA LIMITED (GB) 1997-11-26 EP claimed
US-5663022-A Recording sheets XEROX CORPORATION (US) 1997-09-02 US claimed
WO-1997023455-A1 PROCESSES FOR PREPARING NON-PEPTIDYL TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-07-03 WO claimed
WO-1997016428-A1 ISOQUINOLINE DERIVATIVES AND ISOQUINOLINE COMBINATORIAL LIBRARIES TORREY PINES INSTITUTE FOR MOLECULAR STUDIES (US) 1997-05-09 WO 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
WO-1996024582-A1 5-(4-SUBST.-PIPERIDINYL-1)-3-ARYL-PENTANOIC ACID DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONIST ZENECA LIMITED (GB) 1996-08-15 WO claimed
EP-0674232-A2 Recording sheets XEROX CORPORATION (US) 1995-09-27 EP claimed
EP-0635508-A1 TETRAHYDROPYRIDINE DERIVATIVE HAVING SUBSTITUENTS ON THREE RINGS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1995-01-25 EP claimed
US-5175285-A POLYMERS DERIVED FROM POLYSUCCINIMIDE, USED AS SURFACE COATINGS FOR MEDICINALS AND FOODS ROHM GMBH CHEMISCHE FABRIK (DE) 1992-12-29 US claimed
US-4597903-A Process for the direct preparation of N,N-disubstituted derivatives for 4,13-diaza-18-crown-6 UNIVERSITY OF MARYLAND (US) 1986-07-01 US claimed