SCHEMBL13855839

SCHEMBL13855839

[N-]=[N+]=NCc1cccc(F)c1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.53
TAAR1 Q96RJ0 4/20 0.47
IDO1 P14902 2/20 0.44
AGXT P21549 2/20 0.44
P2RX7 Q99572 8/20 0.44
GRIN2B Q13224 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL13887515 0.86 GRIN2D (0.43) MIFGRIN2BALDH1A1SMN1; SMN2
SCHEMBL14270116 0.79 IDO1 (0.37) IDO1
SCHEMBL13855831 0.78 HTR3E (0.52) TAAR1IDO1AGXTGRIN2B
SCHEMBL14648573 0.77 TAAR1 (0.46) TAAR1IDO1P2RX7
SCHEMBL14872978 0.77 PDE2A (0.39) IDO1GRIN2BALDH1A1SMN1; SMN2
SCHEMBL16401935 0.77 ENPP2 (0.48) MIFTAAR1ALDH1A1SMN1; SMN2
SCHEMBL18795026 0.77 CYP1A2 (0.53) IDO1GRIN2BSMN1; SMN2
SCHEMBL16097145 0.77 TAAR1 (0.46) TAAR1IDO1AGXTSMN1; SMN2
SCHEMBL13921682 0.77 MAOB (0.47) GRIN2BALDH1A1
SCHEMBL16363565 0.77 MIF (0.57) MIFTAAR1IDO1GRIN2BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118994141-A Phenylthiazole derivative with anti-liver cancer and anti-inflammatory activities and preparation method and application thereof 河南科技大学 2024-11-22 CN claimed
CN-118994140-A Triazole derivative with antidepressant effect, and preparation method and application thereof 河南科技大学 2024-11-22 CN claimed
CN-115636817-A Isatin derivative containing triazole ring and preparation method and application thereof 山东大学 2023-01-24 CN claimed
CN-109705095-B Fused ring p-benzoquinone CDC25 protein phosphatase inhibitor containing triazole ring, and preparation method and application thereof 山东大学 2021-06-08 CN claimed
US-12473263-B2 Bicyclic inhibitors of CBX chromodomains ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2025-11-18 US disclosed
WO-2025104092-A1 MODULATORS OF SEPTIN 6 FOR USE IN THE PREVENTION AND/OR TREATMENT OF NEURODEGENERATIVE DISORDERS REMYND N.V. (BE) 2025-05-22 WO disclosed
WO-2025104081-A1 TRIAZOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISORDERS REMYND N.V. (BE) 2025-05-22 WO disclosed
CN-118994140-A Triazole derivative with antidepressant effect, and preparation method and application thereof 河南科技大学 2024-11-22 CN disclosed
CN-118994141-A Phenylthiazole derivative with anti-liver cancer and anti-inflammatory activities and preparation method and application thereof 河南科技大学 2024-11-22 CN disclosed
CN-115636817-B Isatin derivative containing triazole ring, and preparation method and application thereof 山东大学 2023-11-24 CN disclosed
CN-115232126-B Beta-carbolin-1, 2, 3-triazole compound, preparation method thereof and application of compound in resisting Alzheimer disease 中国人民解放军北部战区总医院 2023-04-25 CN disclosed
CN-115636817-A Isatin derivative containing triazole ring and preparation method and application thereof 山东大学 2023-01-24 CN disclosed
US-20130281499-A1 COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2013-10-24 US disclosed
US-20130281499-A1 COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2013-10-24 US disclosed
US-8486977-B2 1,2,3-triazole derivatives for use as stearoyl-CoA desaturase inhibitors GLAXOSMITHKLINE LLC (US) 2013-07-16 US disclosed
US-8486977-B2 1,2,3-triazole derivatives for use as stearoyl-CoA desaturase inhibitors GLAXOSMITHKLINE LLC (US) 2013-07-16 US disclosed
EP-2368887-A1 1, 2, 3-triazole derivatives for use as stearoyl-COA desaturase inhibitors Glaxosmithkline LLC (US) 2011-09-28 EP disclosed
US-20100297054-A1 1,2,3-TRIAZOLE DERIVATIVES FOR USE AS STEAROYL-COA DESATURASE INHIBITORS SMITHKLINE BEECHAM CORPORATION 2010-11-25 US disclosed
US-20100297054-A1 1,2,3-TRIAZOLE DERIVATIVES FOR USE AS STEAROYL-COA DESATURASE INHIBITORS SMITHKLINE BEECHAM CORPORATION 2010-11-25 US disclosed
WO-2009060053-A1 1, 2, 3-TRIAZOLE DERIVATIVES FOR USE AS STEAROYL-COA DESATURASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-05-14 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 (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-12473263-B2 Bicyclic inhibitors of CBX chromodomains CBX2, CBX3, CBX6 MIF 4076/4885TAAR1 2357/4885IDO1 892/4885
US-20100297054-A1 1,2,3-TRIAZOLE DERIVATIVES FOR USE AS STEAROYL-COA DESATURASE INHIBITORS SCD, SCD5, FASN MIF 3551/4885TAAR1 4356/4885IDO1 1095/4885
US-20130281499-A1 COMPOUNDS CYP11B2, SCD, CYP11B1 MIF 1278/4885TAAR1 4555/4885IDO1 2791/4885

“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.