SCHEMBL18790706

SCHEMBL18790706

CN1CCC(NC(=O)CN2CCN(c3cc(-c4ccc(Cl)cc4)cnn3)CC2)CC1=O

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 19/20 0.72
▸ CYP11B1 P15538 1/20 0.42
▸ GRIN1 Q05586 1/20 0.41
▸ GRIN2B Q13224 1/20 0.41

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
SCHEMBL18790704 0.77 SLC6A9 (0.47) CYP11B2CYP11B1
SCHEMBL20513563 0.74 CYP11B2 (0.71) CYP11B2CYP11B1
SCHEMBL20513565 0.74 CYP11B2 (0.71) CYP11B2CYP11B1
SCHEMBL18790710 0.71 CYP11B2 (0.54) CYP11B2
SCHEMBL20546955 0.69 CYP11B2 (0.56) CYP11B2GRIN1GRIN2B
SCHEMBL20513745 0.69 CYP11B2 (0.56) CYP11B2GRIN1GRIN2B
SCHEMBL18791032 0.69 CYP11B2 (0.48) CYP11B2CYP11B1
SCHEMBL18791093 0.68 CYP11B2 (0.66) CYP11B2CYP11B1GRIN2B
SCHEMBL22236794 0.68 USP30 (0.46) CYP11B2CYP11B1
SCHEMBL18790707 0.67 CYP11B2 (0.50) CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3381904-B1 NOVEL NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2021-07-28 — — EP disclosed
US-10717731-B2 Nitrogen-containing aromatic heterocyclic compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2020-07-21 — — US disclosed
WO-2017069226-A1 NOVEL NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPOUND 田辺三菱製薬株式会社 2017-04-27 — — 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 (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 8/4885CYP11B1 6/4885GRIN1 1262/4885

“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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