SCHEMBL21945535

SCHEMBL21945535

Oc1cc(F)cc(OCc2ccc(Cl)c(F)c2)c1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 1/20 0.43
▸ KDM5A P29375 1/20 0.42
▸ KDM5B Q9UGL1 1/20 0.42
▸ F9 P00740 1/20 0.42
▸ F10 P00742 1/20 0.42
▸ MAOB P27338 10/20 0.41
▸ MAOA P21397 2/20 0.40
▸ FFAR1 O14842 1/20 0.37
▸ S1PR1 P21453 1/20 0.37
▸ S1PR5 Q9H228 1/20 0.37
▸ MRGPRX4 Q96LA9 1/20 0.37

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
SCHEMBL21944590 0.81 KDM4A (0.45) KDM5AMAOBMRGPRX4
SCHEMBL21944603 0.80 MAOB (0.53) MAOBMAOA
SCHEMBL18002543 0.80 MAOA (0.50) HRH3KDM5AKDM5BF9F10
SCHEMBL21944596 0.78 MRGPRX4 (0.48) MAOBS1PR1MRGPRX4
SCHEMBL21944906 0.76 MAOB (0.59) MAOBMAOAMRGPRX4
SCHEMBL21945065 0.76 CYP4F2 (0.41) MAOBMRGPRX4
SCHEMBL16886123 0.76 CYP1A2 (0.58) MAOBFFAR1
SCHEMBL31183087 0.76 CYP1A2 (0.58) MAOBFFAR1
SCHEMBL26128487 0.75 MAOB (0.60) MAOBMAOA
SCHEMBL17514959 0.75 HRH3 (0.42) HRH3KDM5AKDM5BF9F10

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 HRH3 4374/4885KDM5A 2810/4885KDM5B 3214/4885

“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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