SCHEMBL23830269

SCHEMBL23830269

CCc1cn(Cc2ccc(N3CC4(CC4)C3)nc2Cl)nn1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 2/20 0.37
NOTUM Q6P988 1/20 0.36
CYP19A1 P11511 5/20 0.35
KCNMA1 Q12791 1/20 0.34
ACHE P22303 2/20 0.33
MGAM O43451 2/20 0.33
GAA P10253 2/20 0.33
SI P14410 2/20 0.33
MGAM2 Q2M2H8 2/20 0.33
HSP90AB1 P08238 3/20 0.33
TYR P14679 1/20 0.33
HRH4 Q9H3N8 1/20 0.32

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
SCHEMBL23830203 0.87 KLKB1 (0.38) KLKB1NOTUMCYP19A1KCNMA1HSP90AB1
SCHEMBL23830185 0.87 KLKB1 (0.42) KLKB1NOTUMCYP19A1HSP90AB1
SCHEMBL23830251 0.86 KLKB1 (0.37) KLKB1NOTUMCYP19A1KCNMA1ACHE
SCHEMBL23830250 0.86 KLKB1 (0.41) KLKB1NOTUMCYP19A1ACHEHSP90AB1
SCHEMBL23781339 0.84 KLKB1 (0.38) KLKB1CYP19A1KCNMA1HSP90AB1
SCHEMBL23830195 0.84 KLKB1 (0.31) KLKB1
SCHEMBL23830160 0.83 KLKB1 (0.36) KLKB1CYP19A1HSP90AB1
SCHEMBL23830178 0.83 KLKB1 (0.39) KLKB1NOTUMCYP19A1ACHETYR
SCHEMBL23769344 0.81 KLKB1 (0.44) KLKB1
SCHEMBL26309357 0.81 NOTUM (0.41) KLKB1NOTUMCYP19A1KCNMA1HSP90AB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240076286-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2024-03-07 US disclosed
US-20240002363-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2024-01-04 US disclosed
US-11760745-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-09-19 US disclosed
US-20210292301-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-09-23 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 (4 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-20210292301-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 KLKB1 1/4885NOTUM 627/4885CYP19A1 59/4885
US-11760745-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors KLKB1, KLK5, KLK1 KLKB1 1/4885NOTUM 627/4885CYP19A1 59/4885
US-20240002363-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 KLKB1 1/4885NOTUM 627/4885CYP19A1 59/4885
US-20240076286-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 KLKB1 1/4885NOTUM 627/4885CYP19A1 59/4885

“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.