SCHEMBL2074734

SCHEMBL2074734

CC(N)Cc1cc2ccccc2[nH]1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.59
DPP4 P27487 1/20 0.52
CASR P41180 2/20 0.48
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47
HTR2B P41595 1/20 0.47
SLC6A2 P23975 2/20 0.47
TAAR1 Q96RJ0 2/20 0.47
MAOA P21397 1/20 0.47
SLC6A4 P31645 1/20 0.47
SLC6A3 Q01959 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
CYP2A6 P11509 1/20 0.47
ADORA2A P29274 1/20 0.47
ADORA1 P30542 1/20 0.47
HRH4 Q9H3N8 1/20 0.46
AOC3 Q16853 1/20 0.46

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
SCHEMBL27324837 1.00 LOXL2 (0.59) LOXL2DPP4CASRHTR2AHTR2C
Acetic Acid SCHEMBL5533726 0.91 MTNR1A (0.52) LOXL2DPP4
SCHEMBL9027554 0.85 LOXL2 (0.58) LOXL2DPP4CASRHRH4
SCHEMBL14680760 0.83 DPP4 (0.54) LOXL2DPP4CASRTAAR1HRH4
SCHEMBL3886864 0.83 DPP4 (0.57) LOXL2DPP4CASRHTR2AHRH4
SCHEMBL5249054 0.82 LOXL2 (0.55) LOXL2DPP4CASRHRH4
SCHEMBL30305027 0.82 LOXL2 (0.55) LOXL2DPP4CASRHRH4
SCHEMBL5365001 0.82 LOXL2 (0.55) LOXL2DPP4CASRHRH4
SCHEMBL18348897 0.81 LOXL2 (0.54) LOXL2DPP4CASRHRH4AOC3
SCHEMBL12936626 0.79 MTNR1A (0.54) LOXL2DPP4

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

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023245161-A2 CATIONIC NONRIBOSOMAL LIPOPEPTIDES AND METHODS OF USE THEREOF THE ROCKEFELLER UNIVERSITY (US) 2023-12-21 WO disclosed
EP-4282867-A1 INDOLINE-CONTAINING SPIRO DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF IN MEDICINE Changchun Genescience Pharmaceutical Co., Ltd. (CN) 2023-11-29 EP disclosed
CN-109311876-B Heteroaryl estrogen receptor modulators and uses thereof 豪夫迈·罗氏有限公司 2022-05-03 CN disclosed
EP-3472162-B1 HETEROARYL ESTROGEN RECEPTOR MODULATORS AND USES THEREOF HOFFMANN LA ROCHE (CH) 2021-11-17 EP disclosed
EP-3472162-B1 HETEROARYL ESTROGEN RECEPTOR MODULATORS AND USES THEREOF HOFFMANN LA ROCHE (CH) 2021-11-17 EP disclosed
US-10654867-B2 Heteroaryl estrogen receptor modulators and uses thereof GENENTECH, INC. (US) 2020-05-19 US disclosed
US-10654867-B2 Heteroaryl estrogen receptor modulators and uses thereof GENENTECH, INC. (US) 2020-05-19 US disclosed
EP-3472162-A1 HETEROARYL ESTROGEN RECEPTOR MODULATORS AND USES THEREOF F. Hoffmann-La Roche AG (CH) 2019-04-24 EP disclosed
US-20180002344-A1 HETEROARYL ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2018-01-04 US disclosed
US-20180002344-A1 HETEROARYL ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2018-01-04 US disclosed
WO-2010030342-A2 HEPAROSAN POLYMERS AND METHODS OF MAKING AND USING SAME FOR THE ENHANCEMENT OF THERAPEUTICS THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 2010-03-18 WO disclosed
EP-1756054-A1 3-AMINO-1-ARYLPROPYL INDOLES AS MONOAMINE REUPTAKE INHIBITOR F.HOFFMANN-LA ROCHE AG (CH) 2007-02-28 EP disclosed
US-20060025467-A1 3-amino-1-arylpropyl indoles as monoamine reuptake inhibitors ROCHE PALO ALTO LLC 2006-02-02 US disclosed
WO-2005118539-A1 3-AMINO-1-ARYLPROPYL INDOLES AS MONOAMINE REUPTAKE INHIBITOR F.HOFFMANN-LA ROCHE AG (CH) 2005-12-15 WO disclosed
EP-0453517-A1 BREATHABLE BACKING NOVEN PHARMACEUTICALS, INC. (US) 1991-10-30 EP disclosed
WO-1990007939-A1 BREATHABLE BACKING NOVEN PHARMACEUTICALS, INC. (US) 1990-07-26 WO disclosed
US-4343802-A ADRENERGIC BLOCKING, ANTIARRYHYTHMIA, AND CARDIOTONIC AGENTS MERCK, SHARP & DOHME (I.A.) CORP. (US) 1982-08-10 US disclosed
US-4193995-A B-ADRENERGIC BLOCKING AGENTS MERCK SHARP & DOHME (I.A.) CORP. (US) 1980-03-18 US disclosed
US-4042586-A ADRENERGIC BLOCKING AGENTS MERCK SHARP & DOHME (I.A.) CORPORATION (US) 1977-08-16 US disclosed
US-3946009-A ADRENERGIC BLOCKING AGENTS MERCK SHARP & DOHME (I.A.) CORPORATION (US) 1976-03-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180002344-A1 HETEROARYL ESTROGEN RECEPTOR MODULATORS AND USES THEREOF ESR2, GPER1, ESRRA LOXL2 919/4885DPP4 2631/4885CASR 423/4885
US-20060025467-A1 3-amino-1-arylpropyl indoles as monoamine reuptake inhibitors TPH1, HTR1A, HTR3A LOXL2 3387/4885DPP4 1235/4885CASR 2198/4885
US-10654867-B2 Heteroaryl estrogen receptor modulators and uses thereof ESR2, GPER1, ESRRA LOXL2 919/4885DPP4 2631/4885CASR 423/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.