SCHEMBL22440191

SCHEMBL22440191

Clc1ccc(CNc2cnc3nc[nH]c3c2)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 2/20 0.49
▸ DYRK1A Q13627 6/20 0.45
▸ CLK4 Q9HAZ1 6/20 0.45
▸ CLK2 P49760 5/20 0.45
▸ CLK1 P49759 3/20 0.45
▸ DYRK1B Q9Y463 3/20 0.45
▸ CLK3 P49761 1/20 0.45
▸ FFAR1 O14842 1/20 0.41
▸ ABL1 P00519 1/20 0.40
▸ ROCK2 O75116 2/20 0.39
▸ PRKACA P17612 2/20 0.39
▸ RPS6KB1 P23443 2/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ AKT1 P31749 2/20 0.39
▸ GSK3A P49840 2/20 0.39
▸ GSK3B P49841 2/20 0.39
▸ RPS6KA3 P51812 2/20 0.39
▸ PRKX P51817 2/20 0.39
▸ CSNK1G2 P78368 2/20 0.39
▸ PRKCD Q05655 2/20 0.39

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
SCHEMBL22440183 0.86 QPCT (0.47) QPCTGAACDC7DBF4
SCHEMBL22440204 0.83 CDC7 (0.56) MAOBCDC7DBF4
SCHEMBL22440192 0.81 DHFR (0.51) QPCTMAPK1
SCHEMBL22440206 0.80 QPCT (0.45) QPCTDYRK1ACLK4CLK2CLK1
SCHEMBL21303610 0.80 QPCT (0.47) QPCTDYRK1ACLK4CLK2CLK1
SCHEMBL22440185 0.79 MAPT (0.54) QPCTGAA
SCHEMBL22440207 0.78 MAPT (0.53) QPCTDYRK1ACLK4CLK1ABL1
SCHEMBL22440210 0.76 LTA4H (0.52) DYRK1ACLK4CLK2CLK1DYRK1B
SCHEMBL22440202 0.76 NPC1 (0.43) DYRK1ACLK1DYRK1BABL1MAPK1
SCHEMBL22440188 0.76 BRAF (0.40) QPCTDYRK1ACLK4CLK2CLK1

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-11958871-B2 Inhibitors of bacterial glutaminyl cyclases for use in the treatment of periodontal and related diseases Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2024-04-16 — — US disclosed
US-20200392174-A1 NOVEL INHIBITORS OF BACTERIAL GLUTAMINYL CYCLASES FOR USE IN THE TREATMENT OF PERIODONTAL AND RELATED DISEASES Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2020-12-17 — — US disclosed
EP-3589632-B1 NOVEL INHIBITORS OF BACTERIAL GLUTAMINYL CYCLASES FOR USE IN THE TREATMENT OF PERIODONTAL AND RELATED DISEASES Fraunhofer-Gesellschaft zur Förderung der Angewandten Forschung Ev (DE) 2020-09-23 — — EP 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-20200392174-A1 NOVEL INHIBITORS OF BACTERIAL GLUTAMINYL CYCLASES FOR USE IN THE TREATMENT OF PERIODONTAL AND RELATED DISEASES GMPS, GLS, QPCT QPCT 3/4885DYRK1A 4411/4885CLK4 1447/4885
US-11958871-B2 Inhibitors of bacterial glutaminyl cyclases for use in the treatment of periodontal and related diseases GMPS, GLS, QPCT QPCT 3/4885DYRK1A 4459/4885CLK4 1628/4885

“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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