SCHEMBL24738873

SCHEMBL24738873

CC(=O)N(C)c1cc(C2CC2)cn2cc(CNc3cc(Cl)ncn3)nc12

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 3/20 0.34
▸ FGFR4 P22455 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ CLK4 Q9HAZ1 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ FGFR3 P22607 1/20 0.31
▸ CYP2C19 P33261 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
SCHEMBL29879385 1.00 KLKB1 (0.34) KLKB1FGFR4ALDH1A1ALOX15HSD17B10
SCHEMBL29879730 0.88 KLKB1 (0.32) KLKB1CYP3A4CYP2C9FGFR3CYP2C19
SCHEMBL29304491 0.88 KLKB1 (0.32) KLKB1CYP3A4CYP2C9FGFR3CYP2C19
SCHEMBL29302902 0.85 KLKB1 (0.39) KLKB1
SCHEMBL30997821 0.85 KLKB1 (0.39) KLKB1
SCHEMBL29879646 0.83 KLKB1 (0.34) KLKB1
SCHEMBL24737532 0.83 KLKB1 (0.34) KLKB1
SCHEMBL24739985 0.82 PRCP (0.35) KLKB1
SCHEMBL30997845 0.82 PRCP (0.35) KLKB1
SCHEMBL24739007 0.82 KLKB1 (0.33) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228488-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN TAKEDA PHARMACEUTICALS CO (JP) 2024-07-11 — — US disclosed
CN-117355521-A Heteroaryl inhibitors of plasma kallikrein 武田药品工业株式会社 2024-01-05 — — CN disclosed
WO-2022197758-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2022-09-22 — — 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 (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-20240228488-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN KLKB1, KLK5, KLK1 KLKB1 1/4885FGFR4 2516/4885ALDH1A1 3026/4885

“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.

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