SCHEMBL23843045

SCHEMBL23843045

CCOC(=O)c1cc(Cc2ccc(N3CC4CC4C3)nc2CO)n(COCC[Si](C)(C)C)n1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 4/20 0.49
DGAT1 O75907 2/20 0.34
NR1H2 P55055 1/20 0.33
FAAH O00519 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
KDM4E B2RXH2 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
PDE10A Q9Y233 1/20 0.31
KMT2A Q03164 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
SCHEMBL26307682 0.90 KLKB1 (0.55) KLKB1
SCHEMBL23843044 0.90 KLKB1 (0.38) KLKB1NR1H2FAAHNPC1RAB9A
SCHEMBL23843125 0.90 KLKB1 (0.49) KLKB1DGAT1NR1H2FAAHNPC1
SCHEMBL23843039 0.89 KLKB1 (0.49) KLKB1DGAT1NR1H2FAAHNPC1
SCHEMBL23843117 0.88 KLKB1 (0.48) KLKB1DGAT1FAAHNPC1RAB9A
SCHEMBL23843118 0.87 KLKB1 (0.51) KLKB1DGAT1RAB9APDE10A
SCHEMBL23843048 0.84 KLKB1 (0.54) KLKB1
SCHEMBL26310201 0.80 KLKB1 (0.43) KLKB1
SCHEMBL26307679 0.80 KLKB1 (0.58) KLKB1DGAT1
SCHEMBL23843040 0.79 KLKB1 (0.38) KLKB1NR1H2FAAHNPC1RAB9A

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
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

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 KLKB1 1/4885DGAT1 3308/4885NR1H2 957/4885
US-11760745-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors KLKB1, KLK5, KLK1 KLKB1 1/4885DGAT1 3308/4885NR1H2 957/4885

“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.