SCHEMBL26310201

SCHEMBL26310201

CS(C)(C)CCOCn1nc(C(=O)O)cc1Cc1ccc(N2CC3CC3C2)nc1CO

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 5/20 0.43
RBP4 P02753 1/20 0.31

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
SCHEMBL23843049 0.94 KLKB1 (0.42) KLKB1RBP4
SCHEMBL23843044 0.91 KLKB1 (0.38) KLKB1
SCHEMBL26307682 0.89 KLKB1 (0.55) KLKB1RBP4
SCHEMBL26310197 0.86 KLKB1 (0.46) KLKB1
SCHEMBL23843048 0.83 KLKB1 (0.54) KLKB1RBP4
SCHEMBL23843140 0.82 KLKB1 (0.44) KLKB1
SCHEMBL23843119 0.80 KLKB1 (0.40) KLKB1
SCHEMBL23843045 0.80 KLKB1 (0.49) KLKB1
SCHEMBL23843112 0.80 KLKB1 (0.45) KLKB1
SCHEMBL23843040 0.79 KLKB1 (0.38) KLKB1

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-11760745-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-09-19 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-11760745-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors KLKB1, KLK5, KLK1 KLKB1 1/4885RBP4 3590/4885

“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.