SCHEMBL1872002

SCHEMBL1872002

NCc1cc(Br)cc(CN)c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.50
TAAR1 Q96RJ0 2/20 0.41
LOXL2 Q9Y4K0 4/20 0.36
HRH3 Q9Y5N1 1/20 0.36
HTR2A P28223 1/20 0.36
AGXT P21549 2/20 0.34
ABAT P80404 1/20 0.33
PNMT P11086 1/20 0.33
ENPP2 Q13822 1/20 0.33
ST14 Q9Y5Y6 1/20 0.33
TACR1 P25103 1/20 0.32
PRMT6 Q96LA8 1/20 0.31

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
SCHEMBL1765119 0.97 IDO1 (0.52) IDO1TAAR1LOXL2HRH3HTR2A
SCHEMBL18494541 0.87 IDO1 (0.41) IDO1TAAR1LOXL2HTR2AABAT
SCHEMBL27824736 0.87 IDO1 (0.41) IDO1TAAR1HTR2AABATENPP2
SCHEMBL11437281 0.84 IDO1 (0.43) IDO1TAAR1LOXL2HRH3HTR2A
SCHEMBL63392 0.83 LOXL2 (0.47) TAAR1LOXL2HRH3ABATPNMT
SCHEMBL24264540 0.82 IDO1 (0.46) IDO1TAAR1AGXTABATENPP2
SCHEMBL16635217 0.82 IDO1 (0.41) IDO1TAAR1HTR2ATACR1
SCHEMBL1363469 0.82 PNMT (0.46) IDO1TAAR1LOXL2PNMT
SCHEMBL2039301 0.82 LOXL2 (0.42) IDO1TAAR1LOXL2
SCHEMBL1363875 0.82 TACR1 (0.44) IDO1TAAR1LOXL2HTR2ATACR1

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4636054-A2 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRvana Sciences Inc. (US) 2025-10-22 EP disclosed
EP-3959292-B1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRVANA SCIENCES INC (US) 2025-07-02 EP disclosed
WO-2025068371-A1 INHIBITORS OF THE PROPROTEIN CONVERTASE FURIN, METHODS OF PRODUCTION THEREOF AND USE PHILIPPS-UNIVERSITÄT MARBURG (DE) 2025-04-03 WO disclosed
EP-3959293-B1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRVANA SCIENCES INC (US) 2024-11-13 EP disclosed
US-20220249708-A1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRVANA SCIENCES INC. (US) 2022-08-11 US disclosed
US-20220249707-A1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRVANA SCIENCES INC. (US) 2022-08-11 US disclosed
EP-3959292-A1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRvana Sciences Inc. (US) 2022-03-02 EP disclosed
EP-3959293-A1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRvana Sciences Inc. (US) 2022-03-02 EP disclosed
WO-2020236818-A1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRVANA SCIENCES INC. (US) 2020-11-26 WO disclosed
WO-2020236828-A1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRVANA SCIENCES INC. (US) 2020-11-26 WO disclosed
US-8796300-B2 Therapeutic compounds RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2014-08-05 US disclosed
US-20120238595-A1 THERAPEUTIC COMPOUNDS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2012-09-20 US disclosed
EP-2496704-A1 THERAPEUTIC COMPOUNDS Rutgers, The State University of New Jersey (US) 2012-09-12 EP disclosed
WO-2011057126-A1 THERAPEUTIC COMPOUNDS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2011-05-12 WO disclosed
CN-101990401-A Dual pharmacophores-PDE 4-muscarinic antagonists GLAXO GROUP LTD 2011-03-23 CN disclosed
CN-101983010-A Dual pharmacophores-pde4-muscarinic antagonistics GLAXO GROUP LTD 2011-03-02 CN disclosed
CN-101983009-A Dual pharmacophores-PDE 4-muscarinic antagonists GLAXO GROUP LTD 2011-03-02 CN 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-20120238595-A1 THERAPEUTIC COMPOUNDS CCNY, MKI67, MCL1 IDO1 2612/4885TAAR1 4425/4885LOXL2 3859/4885
US-20220249707-A1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME AQP4, CLSPN, CHLSN IDO1 2350/4885TAAR1 4410/4885LOXL2 4114/4885
US-20220249708-A1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME MB, LNPEP, BCR IDO1 1621/4885TAAR1 4499/4885LOXL2 4052/4885

“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.