SCHEMBL21944812

SCHEMBL21944812

Oc1cc(OCCC2CCCCC2)cc(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 1/20 0.47
▸ ALOX5 P09917 1/20 0.41
▸ HPGD P15428 7/20 0.39
▸ ADAMTS4 O75173 1/20 0.38
▸ ADAMTS5 Q9UNA0 1/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.37
▸ CNR1 P21554 6/20 0.36
▸ CNR2 P34972 6/20 0.36

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
SCHEMBL21944889 0.87 PDK2 (0.43) —
SCHEMBL21944574 0.85 PDK2 (0.42) —
SCHEMBL18002520 0.80 NFE2L2 (0.43) NFE2L2ALOX5HPGD
SCHEMBL22816889 0.79 RBP4 (0.41) CNR1CNR2
SCHEMBL21945034 0.76 GPR35 (0.40) —
SCHEMBL17048575 0.75 CNR1 (0.45) CNR1CNR2
SCHEMBL27980673 0.73 NFE2L2 (0.70) NFE2L2HPGDHRH3
SCHEMBL9698583 0.72 CNR1 (0.57) CNR1CNR2
SCHEMBL10212065 0.70 NFE2L2 (0.51) NFE2L2ALOX5HPGDHRH3
SCHEMBL21945459 0.70 GPR84 (0.54) ALOX5

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 NFE2L2 1380/4885ALOX5 3378/4885HPGD 2152/4885

“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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