SCHEMBL22236836

SCHEMBL22236836

O=C(CN1CCN(c2cncc(-c3ccc(F)cc3)n2)CC1)NC1CCCCC1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 18/20 0.58
▸ ALDH1A1 P00352 2/20 0.55

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
SCHEMBL22236835 0.88 CYP11B2 (0.74) CYP11B2
SCHEMBL27132479 0.74 CYP11B2 (0.84) CYP11B2
SCHEMBL18508452 0.74 CYP11B2 (0.85) CYP11B2
SCHEMBL17207554 0.74 CYP11B2 (0.79) CYP11B2
SCHEMBL17207663 0.74 CYP11B2 (0.73) CYP11B2
SCHEMBL18489968 0.73 CYP11B2 (0.84) CYP11B2
SCHEMBL28557913 0.73 CYP11B2 (0.84) CYP11B2
SCHEMBL28557916 0.73 CYP11B2 (0.84) CYP11B2
SCHEMBL15578305 0.73 SCN9A (0.60) CYP11B2ALDH1A1
SCHEMBL20514041 0.73 CYP11B2 (0.68) CYP11B2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10717731-B2 Nitrogen-containing aromatic heterocyclic compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2020-07-21 — — 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-10717731-B2 Nitrogen-containing aromatic heterocyclic compound REN, NR3C2, NR5A1 CYP11B2 8/4885ALDH1A1 1495/4885

“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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