SCHEMBL14471375

SCHEMBL14471375

N#Cc1ccc(CN=[N+]=[N-])nc1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MBOAT4 Q96T53 1/20 0.37
▸ ALDH1A1 P00352 6/20 0.36
▸ KDM4E B2RXH2 5/20 0.36
▸ L3MBTL1 Q9Y468 3/20 0.36
▸ LMNA P02545 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ HPGD P15428 2/20 0.32
▸ HTT P42858 1/20 0.32
▸ CYP2A6 P11509 1/20 0.31
▸ EGLN2 Q96KS0 1/20 0.31
▸ CYP19A1 P11511 1/20 0.31
▸ PRMT5 O14744 1/20 0.30
▸ WDR77 Q9BQA1 1/20 0.30
▸ XDH P47989 1/20 0.30
▸ GRM5 P41594 1/20 0.30

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
SCHEMBL26908232 0.76 KDM4E (0.47) ALDH1A1KDM4EL3MBTL1HPGDHTT
SCHEMBL29818961 0.76 KDM4E (0.47) ALDH1A1KDM4EL3MBTL1HPGDHTT
SCHEMBL15409988 0.75 KDM4E (0.37) ALDH1A1KDM4E
SCHEMBL16560329 0.75 CCR1 (0.40) ALDH1A1KDM4ECYP2A6
SCHEMBL16166585 0.74 KDM4E (0.36) MBOAT4ALDH1A1KDM4EL3MBTL1
SCHEMBL22122693 0.74 KDM4E (0.36) ALDH1A1KDM4E
SCHEMBL15856196 0.74 GBA1 (0.38) MBOAT4ALDH1A1KDM4E
SCHEMBL13878887 0.74 HTR2C (0.37) MBOAT4ALDH1A1KDM4E
SCHEMBL14270233 0.73 LOXL2 (0.47) ALDH1A1CYP2A6CYP19A1
SCHEMBL14948664 0.71 HRH3 (0.43) ALDH1A1KDM4EL3MBTL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114269739-B 1,3, 4-Diazole derivatives as histone deacetylase inhibitors 奎马特里克斯公司 2025-04-22 — — CN disclosed
EP-3956324-B1 1,3,4-OXADIAZOLE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS QUIMATRYX S L (ES) 2024-02-21 — — EP disclosed
US-20220213084-A1 1,3,4-OXADIAZOLE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS FUNDACIÓN KERTOR (ES) 2022-07-07 — — US disclosed
CN-114269739-A 1,3,4- Oxadiazole derivatives as histone deacetylase inhibitors 奎马特里克斯公司 2022-04-01 — — CN disclosed
EP-3956324-A1 1,3,4-OXADIAZOLE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS QUIMATRYX, S.L. (ES) 2022-02-23 — — EP disclosed
WO-2020212479-A1 1,3,4-OXADIAZOLE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS QUIMATRYX, S.L. (ES) 2020-10-22 — — WO disclosed
EP-1808440-B1 Non-covalent inhibitors of urokinase and blood vessel formation WILEX AG (DE) 2011-07-27 — — EP disclosed
EP-1808440-A1 Non-covalent inhibitors of urokinase and blood vessel formation Wilex AG (DE) 2007-07-18 — — EP disclosed
EP-1182207-B1 Non-covalent inhibitors of urokinase and blood vessel formation DENDREON CORP (US) 2007-04-18 — — EP 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 (1 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-20220213084-A1 1,3,4-OXADIAZOLE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS HDAC6, HDAC1, HDAC3 MBOAT4 1946/4885ALDH1A1 351/4885KDM4E 797/4885

“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.

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