SCHEMBL22440199

SCHEMBL22440199

CCCOc1ccc(CNc2cnc3nc[nH]c3c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.40
▸ PIK3CA P42336 1/20 0.40
▸ ABL1 P00519 1/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ PTPN7 P35236 1/20 0.39
▸ DUSP3 P51452 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ QPCT Q16769 1/20 0.38
▸ CACNA1B Q00975 2/20 0.38
▸ GAA P10253 1/20 0.37
▸ P2RY14 Q15391 1/20 0.37

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
SCHEMBL21295263 0.88 PIK3CA (0.38) MAPTPIK3CAABL1KDM4EALDH1A1
SCHEMBL22440207 0.86 MAPT (0.53) MAPTPIK3CAABL1KDM4EALDH1A1
SCHEMBL21303624 0.82 ABL1 (0.42) MAPTABL1KDM4EALDH1A1HPGD
SCHEMBL30770890 0.82 QPCT (0.36) MAPTPIK3CAABL1KDM4EALDH1A1
SCHEMBL21295277 0.82 QPCT (0.36) MAPTPIK3CAABL1KDM4EALDH1A1
SCHEMBL22440183 0.80 QPCT (0.47) MAPTKDM4EALDH1A1KMT2AL3MBTL1
SCHEMBL22900298 0.80 MAPT (0.48) MAPTKDM4EALDH1A1HPGDKMT2A
SCHEMBL22440192 0.79 DHFR (0.51) PIK3CAQPCT
SCHEMBL22440185 0.77 MAPT (0.54) MAPTKDM4EALDH1A1KMT2ARAB9A
SCHEMBL22440179 0.76 QPCT (0.53) MAPTPIK3CAKDM4EALDH1A1KMT2A

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 MAPT 4289/4885PIK3CA 2620/4885ABL1 3351/4885
US-11958871-B2 Inhibitors of bacterial glutaminyl cyclases for use in the treatment of periodontal and related diseases GMPS, GLS, QPCT MAPT 4117/4885PIK3CA 2568/4885ABL1 3082/4885

“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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