SCHEMBL21945065

SCHEMBL21945065

Oc1cc(F)cc(OCc2cc(F)cc(Cl)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 1/20 0.41
▸ CYP4A11 Q02928 1/20 0.41
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ GSK3B P49841 2/20 0.38
▸ BACE1 P56817 2/20 0.38
▸ DAO P14920 2/20 0.37
▸ MRGPRX4 Q96LA9 1/20 0.37
▸ MAOB P27338 4/20 0.36
▸ FFAR4 Q5NUL3 1/20 0.36
▸ IDO1 P14902 4/20 0.36
▸ ABL1 P00519 1/20 0.35
▸ SRC P12931 1/20 0.35

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
SCHEMBL21944908 0.85 MRGPRX4 (0.42) MRGPRX4MAOBIDO1
SCHEMBL21944924 0.84 MRGPRX4 (0.42) CYP4F2CYP4A11MRGPRX4FFAR4
SCHEMBL21945533 0.83 APP (0.53) MAOB
SCHEMBL18002570 0.78 MAOA (0.49) GSK3BBACE1MRGPRX4MAOBFFAR4
SCHEMBL21944929 0.78 IDO1 (0.42) CYP4F2CYP4A11MRGPRX4MAOBFFAR4
SCHEMBL21944603 0.77 MAOB (0.53) MAOB
SCHEMBL22597337 0.77 MAOB (0.49) MAOB
SCHEMBL21944906 0.77 MAOB (0.59) MRGPRX4MAOB
SCHEMBL21945535 0.76 HRH3 (0.43) MRGPRX4MAOB
SCHEMBL16886123 0.76 CYP1A2 (0.58) CYP4F2CYP4A11MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-10626095-B2 Cyanotriazole compounds CS, PC, ACAT1 CYP4F2 1779/4885CYP4A11 935/4885CA12 900/4885

“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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