SCHEMBL20541015

SCHEMBL20541015

CCOC(=O)c1cn(Cc2ccc(N3CC4CC4C3)nc2C)nn1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 13/20 0.56
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
BTK Q06187 3/20 0.44
GLA P06280 1/20 0.42

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
SCHEMBL31033209 1.00 KLKB1 (0.56) KLKB1ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL23769155 0.91 ALDH1A1 (0.50) KLKB1ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL23469694 0.91 KLKB1 (0.59) KLKB1BTK
SCHEMBL23769187 0.90 ALDH1A1 (0.52) KLKB1ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL23769282 0.90 ALDH1A1 (0.49) KLKB1ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL23753965 0.90 ALDH1A1 (0.52) KLKB1ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL30027310 0.90 ALDH1A1 (0.52) KLKB1ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL23754188 0.89 ALDH1A1 (0.48) KLKB1ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL23768900 0.89 ALDH1A1 (0.48) KLKB1ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL23769260 0.89 ALDH1A1 (0.48) KLKB1ALDH1A1LMNAHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3837252-B1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2025-12-10 EP disclosed
CN-113039181-B Heteroaromatic carboxamide derivatives as inhibitors of plasma kallikrein 勃林格殷格翰国际有限公司 2024-08-13 CN disclosed
CN-110546146-B Heteroaryl carboxamide derivatives as plasma kallikrein inhibitors 勃林格殷格翰国际有限公司 2023-02-21 CN disclosed
EP-3612523-B1 HETEROARYLCARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2021-06-09 EP disclosed
EP-3612523-B1 HETEROARYLCARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2021-06-09 EP disclosed
US-10695334-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2020-06-30 US disclosed
US-10695334-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2020-06-30 US disclosed
US-20200054617-A1 Heteroaromatic Carboxamide Derivatives as Plasma Kallikrein Inhibitors BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2020-02-20 US disclosed
WO-2020035540-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2020-02-20 WO disclosed
US-20200054617-A1 Heteroaromatic Carboxamide Derivatives as Plasma Kallikrein Inhibitors BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2020-02-20 US disclosed
US-20180305339-A1 Heteroarylcarboxamide Derivatives as Plasma Kallikrein Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-10-25 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 (3 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-20180305339-A1 Heteroarylcarboxamide Derivatives as Plasma Kallikrein Inhibitors KLKB1, KLK5, KLK1 KLKB1 1/4885ALDH1A1 1715/4885LMNA 1489/4885
US-20200054617-A1 Heteroaromatic Carboxamide Derivatives as Plasma Kallikrein Inhibitors KLKB1, KLK1, KLK5 KLKB1 1/4885ALDH1A1 1415/4885LMNA 1430/4885
US-10695334-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors KLKB1, KLK1, KLK5 KLKB1 1/4885ALDH1A1 1415/4885LMNA 1430/4885

“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.