SCHEMBL16403054

SCHEMBL16403054

N#Cc1nn[nH]c1-c1cc(Cl)cc(/C=C/c2ccc(F)cc2)c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.37
▸ TP53 P04637 4/20 0.37
▸ AHR P35869 2/20 0.36
▸ PTGS1 P23219 1/20 0.34
▸ CYP17A1 P05093 2/20 0.33
▸ ERBB2 P04626 1/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ CYP21A2 P08686 1/20 0.33
▸ CYP11B1 P15538 1/20 0.33
▸ GAA P10253 1/20 0.32

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
SCHEMBL16403056 1.00 MAPT (0.37) MAPTTP53AHRPTGS1CYP17A1
SCHEMBL16399607 0.85 NFE2L2 (0.40) MAPTTP53PTGS1ERBB2NFE2L2
SCHEMBL16399605 0.85 NFE2L2 (0.40) MAPTTP53PTGS1ERBB2NFE2L2
SCHEMBL16402513 0.84 NFE2L2 (0.44) MAPTTP53ERBB2NFE2L2
SCHEMBL16402512 0.84 NFE2L2 (0.44) MAPTTP53ERBB2NFE2L2
SCHEMBL16399373 0.82 AHR (0.40) AHRGAA
SCHEMBL16399529 0.82 AHR (0.36) MAPTTP53AHRPTGS1CYP17A1
SCHEMBL17969056 0.82 AHR (0.40) AHRGAA
SCHEMBL16399531 0.82 AHR (0.36) MAPTTP53AHRPTGS1CYP17A1
SCHEMBL16402743 0.81 NQO2 (0.36) MAPTTP53PTGS1NFE2L2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4570313-A2 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2025-06-18 — — EP claimed
EP-4219477-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-08-02 — — EP claimed
US-10626095-B2 Cyanotriazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-04-21 — — US claimed
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 — — US claimed
EP-3022199-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2016-05-25 — — EP claimed
WO-2015008872-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-01-22 — — WO claimed
EP-4570313-A2 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2025-06-18 — — EP disclosed
EP-4219477-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-08-02 — — EP disclosed
US-10626095-B2 Cyanotriazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-04-21 — — US disclosed
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 — — US disclosed
EP-3022199-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2016-05-25 — — EP disclosed
WO-2015008872-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-01-22 — — 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 (2 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-10626095-B2 Cyanotriazole compounds CS, PC, ACAT1 MAPT 2196/4885TP53 1634/4885AHR 3515/4885
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS CS, PC, ACAT1 MAPT 2196/4885TP53 1634/4885AHR 3515/4885

“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.

Send feedback