SCHEMBL23769263

SCHEMBL23769263

CCOC(=O)c1cnn(Cc2ncc(N3CC4CC4C3)nc2C=O)c1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BTK Q06187 10/20 0.39
KLKB1 P03952 8/20 0.38
GRM2 Q14416 1/20 0.38
PDE10A Q9Y233 1/20 0.34

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
SCHEMBL23769657 0.93 BTK (0.38) BTKKLKB1GRM2PDE10A
SCHEMBL23769262 0.87 BTK (0.39) BTKKLKB1GRM2PDE10A
SCHEMBL23769685 0.87 BTK (0.39) BTKKLKB1GRM2PDE10A
SCHEMBL29906533 0.86 KLKB1 (0.47) BTKKLKB1GRM2PDE10A
SCHEMBL23754010 0.86 KLKB1 (0.47) BTKKLKB1GRM2PDE10A
SCHEMBL18795038 0.82 BTK (0.52) BTKKLKB1GRM2PDE10A
SCHEMBL23769250 0.82 KLKB1 (0.46) BTKKLKB1GRM2
SCHEMBL23769324 0.80 KLKB1 (0.46) BTKKLKB1GRM2PDE10A
SCHEMBL29906634 0.80 KLKB1 (0.46) BTKKLKB1GRM2PDE10A
SCHEMBL23769328 0.79 KLKB1 (0.48) BTKKLKB1GRM2PDE10A

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-11760745-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-09-19 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
WO-2021160718-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-08-19 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 (2 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 BTK 1516/4885KLKB1 1/4885GRM2 4051/4885
US-11760745-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors KLKB1, KLK5, KLK1 BTK 1516/4885KLKB1 1/4885GRM2 4051/4885

“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.