SCHEMBL2860410

SCHEMBL2860410

NCc1ccc2nccnc2c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 11/20 0.47
LOX P28300 3/20 0.47
LOXL3 P58215 1/20 0.47
ECE2 P0DPD6 1/20 0.45
ROCK1 Q13464 1/20 0.44
SHMT2 P34897 1/20 0.44
ADRB2 P07550 1/20 0.42
HRH3 Q9Y5N1 1/20 0.39
NOS1 P29475 1/20 0.37
NOS2 P35228 1/20 0.37
KEAP1 Q14145 1/20 0.37

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
SCHEMBL31367022 1.00 LOXL2 (0.47) LOXL2LOXLOXL3ECE2ROCK1
Hydrochloric Acid SCHEMBL28952754 0.98 LOXL2 (0.45) LOXL2LOXLOXL3ECE2ROCK1
SCHEMBL2859216 0.83 TAAR1 (0.45) LOXL2ECE2SHMT2ADRB2
SCHEMBL3387430 0.79 NOS3 (0.50) LOXL2ADRB2NOS1NOS2
SCHEMBL7029899 0.79 ECE2 (0.46) ECE2SHMT2
SCHEMBL843959 0.77 ECE2 (0.45) ECE2SHMT2
SCHEMBL6763074 0.77 ECE2 (0.49) ECE2SHMT2
SCHEMBL3820906 0.77 ECE2 (0.45) ECE2SHMT2
SCHEMBL9611255 0.77 ECE2 (0.45) ECE2SHMT2
SCHEMBL2056360 0.77 NOS3 (0.52) ECE2SHMT2NOS1NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4727932-A1 SMALL MOLECULE LIGANDS AND APTAMERS MeiraGTx Gene Regulation Limited (GB) 2026-04-22 EP disclosed
EP-4635568-A2 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA Pharmaceuticals Inc. (US) 2025-10-22 EP disclosed
EP-3672954-B1 COMPOUNDS, SALTS THEREOF AND THEIR USE FOR THE TREATMENT OF DISEASES ACADIA PHARM INC (US) 2025-08-13 EP disclosed
US-20250197385-A1 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA PHARM INC (US) 2025-06-19 US disclosed
WO-2024256870-A1 SMALL MOLECULE LIGANDS AND APTAMERS MEIRAGTX UK II LIMITED (GB) 2024-12-19 WO disclosed
US-12139477-B2 Compounds, salts thereof and methods for treatment of diseases ACADIA PHARMACEUTICALS INC. (US) 2024-11-12 US disclosed
WO-2024165017-A1 HETEROCYCLIC COMPOUND AND USE THEREOF 成都先导药物开发股份有限公司 2024-08-15 WO disclosed
EP-3365334-B1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS OTSUKA PHARMA CO LTD (JP) 2024-07-17 EP disclosed
US-11535597-B2 Photoreactive ligands and uses thereof THE SCRIPPS RESEARCH INSTITUTE (US) 2022-12-27 US disclosed
US-20220298151-A1 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA PHARMACEUTICALS INC. (US) 2022-09-22 US disclosed
WO-2013029830-A1 POROUS MATERIALS CONTAINING BUILT-IN SINGLE MOLECULE TRAPS FOR SMALL MOLECULE CAPTURE THE TEXAS A&M UNIVERSITY SYSTEM (US) 2013-03-07 WO disclosed
EP-2346848-B1 QUINAZOLINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2013-02-27 EP disclosed
US-8318749-B2 Quinazoline derivatives as NK3 receptor antagonists HOFFMANN-LA ROCHE INC. (US) 2012-11-27 US disclosed
US-20120149700-A1 2-CYANOPHENYL FUSED HETEROCYCLIC COMPOUNDS, AND COMPOSTIONS AND USES THEREOF WEI ZHI-LIANG (US) 2012-06-14 US disclosed
US-8076345-B2 2-cyanophenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine compounds, compositions and uses thereof EVOTEC AG (DE) 2011-12-13 US disclosed
US-20100125078-A1 QUINAZOLINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS HOFFMANN-LA ROCHE, INC. 2010-05-20 US disclosed
EP-2139334-A1 2-CYANOPHENYL FUSED HETEROCYCLIC COMPOUNDS, AND COMPOSITIONS AND USES THEREOF Renovis, Inc. (US) 2010-01-06 EP disclosed
US-7592345-B2 Piperazine and [1,4]diazepan derivatives as NK antagonists HOFFMANN-LA ROCHE INC. (US) 2009-09-22 US disclosed
US-20080275037-A1 2-Cyanophenyl fused heterocyclic compounds, and compositions and uses thereof EVOTEC AG (DE) 2008-11-06 US disclosed
WO-2008130481-A1 2-CYANOPHENYL FUSED HETEROCYCLIC COMPOUNDS, AND COMPOSITIONS AND USES THEREOF RENOVIS, INC. (US) 2008-10-30 WO 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 (7 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-11535597-B2 Photoreactive ligands and uses thereof CLTB, CRYAB, CRYAA LOXL2 1923/4885LOX 2441/4885LOXL3 1695/4885
US-20100125078-A1 QUINAZOLINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS SLC6A3, OPRK1, HTR3A LOXL2 4319/4885LOX 4119/4885LOXL3 2019/4885
US-20220298151-A1 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES SLC10A1, CYP27A1, CYP11B2 LOXL2 1837/4885LOX 734/4885LOXL3 1743/4885
US-12139477-B2 Compounds, salts thereof and methods for treatment of diseases SLC10A1, CYP27A1, CYP11B2 LOXL2 1837/4885LOX 734/4885LOXL3 1743/4885
US-20120149700-A1 2-CYANOPHENYL FUSED HETEROCYCLIC COMPOUNDS, AND COMPOSTIONS AND USES THEREOF IL1B, IL1A, CRHR1 LOXL2 3056/4885LOX 2553/4885LOXL3 3780/4885
US-20080275037-A1 2-Cyanophenyl fused heterocyclic compounds, and compositions and uses thereof CNR2, CNR1, CBR1 LOXL2 1725/4885LOX 1236/4885LOXL3 2542/4885
US-20250197385-A1 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES SLC10A1, CYP27A1, CYP11B2 LOXL2 1837/4885LOX 734/4885LOXL3 1743/4885

“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.