SCHEMBL23769272

SCHEMBL23769272

CCc1nc(N2CC3(CC3)C2)ccc1Cc1cc(C(=O)O)on1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
KLKB1 P03952 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30
PTGDR2 Q9Y5Y4 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PARP1 P09874 1/20 0.30
PARP2 Q9UGN5 1/20 0.30

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
SCHEMBL23769676 0.88 SLC26A6 (0.36) ALDH1A1HPGDSMN1; SMN2
SCHEMBL23769271 0.85 EPHX2 (0.31) HCAR2
SCHEMBL23769359 0.83 KLKB1 (0.43) GAAHCAR2KLKB1
SCHEMBL23769266 0.83 TRPA1 (0.33) HCAR2KLKB1
SCHEMBL23769494 0.76 MAPT (0.37) GAAALDH1A1HPGDSMN1; SMN2
SCHEMBL23830263 0.76
SCHEMBL31357730 0.74 TRPV3 (0.34) KLKB1ALDH1A1HPGDHSD17B10
SCHEMBL23754040 0.74 TRPV3 (0.34) KLKB1ALDH1A1HPGDHSD17B10
SCHEMBL23769358 0.74 KLKB1 (0.42) HCAR2KLKB1
SCHEMBL23769353 0.73 KLKB1 (0.32) 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 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 GAA 829/4885HCAR2 148/4885KLKB1 1/4885
US-11760745-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors KLKB1, KLK5, KLK1 GAA 829/4885HCAR2 148/4885KLKB1 1/4885

“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.