SCHEMBL21360490

SCHEMBL21360490

COc1cccc(C(=O)N2CC3CN(Cc4c(-c5ccc(Cl)cc5)nc5ccccn45)CC3C2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 20/20 1.00
▸ KCNK9 Q9NPC2 20/20 1.00

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
SCHEMBL29432816 1.00 KCNK3 (1.00) KCNK3KCNK9
SCHEMBL21360501 0.92 KCNK3 (1.00) KCNK3KCNK9
SCHEMBL29458039 0.92 KCNK3 (1.00) KCNK3KCNK9
SCHEMBL25426294 0.92 KCNK3 (1.00) KCNK3KCNK9
SCHEMBL21360480 0.90 KCNK3 (1.00) KCNK3KCNK9
SCHEMBL29458035 0.90 KCNK3 (1.00) KCNK3KCNK9
SCHEMBL18963200 0.89 KCNK3 (1.00) KCNK3KCNK9
SCHEMBL29458044 0.89 KCNK3 (1.00) KCNK3KCNK9
SCHEMBL22636272 0.88 KCNK3 (0.79) KCNK3KCNK9
SCHEMBL29458033 0.88 KCNK3 (0.79) KCNK3KCNK9

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-10414765-B2 Substituted perhydropyrrolo[3,4-c]pyrrole derivatives and the use of same BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-09-17 — — 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-10414765-B2 Substituted perhydropyrrolo[3,4-c]pyrrole derivatives and the use of same PAH, EGLN3, HYOU1 KCNK3 1716/4885KCNK9 2925/4885

“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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