SCHEMBL14076358

SCHEMBL14076358

Cc1ccc2occ(C3/C(=N/C4CCCCC4O)NC(=O)N3c3ccc4[nH]cnc4c3)c(=O)c2c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 12/20 0.40
▸ ALDH1A1 P00352 5/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ MAPT P10636 2/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ GFER P55789 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.31
▸ TSHR P16473 2/20 0.30
▸ QPCTL Q9NXS2 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ THRB P10828 1/20 0.30
▸ HPGD P15428 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
SCHEMBL5058023 1.00 QPCT (0.40) QPCTALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL5062210 0.94 QPCT (0.36) QPCTALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL14076473 0.94 QPCT (0.36) QPCTALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL14076624 0.91 QPCT (0.36) QPCTALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL5063736 0.91 QPCT (0.36) QPCTALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL14076687 0.86 QPCT (0.44) QPCTALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL5061894 0.86 QPCT (0.44) QPCTALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL5061897 0.86 QPCT (0.44) QPCTALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL5053568 0.83 QPCT (0.38) QPCTALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL14076495 0.83 QPCT (0.38) QPCTALDH1A1KDM4EMAPTSMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2091945-B1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2014-01-15 — — EP disclosed
US-8420684-B2 imidazole derivatives; Alzheimer's Disease, Down syndrome, Huntington's Disease; hypotensive agents; sleeping/eating disorders, anxiolytic agents, antidepressants, antiepileptic agents; drug abuse/withdrawl; 4-Cyclopropylimino-5-(3,4-dihydro-2H-pyran-2-yl)-1-(3-imidazol-1-yl-propyl)-imidazolidin-2-one PROBIODRUG AG (DE) 2013-04-16 — — US disclosed
US-20080221086-A1 Novel Inhibitors of Glutaminyl Cyclase PROBIODRUG AG (DE) 2008-09-11 — — US disclosed
US-20080221086-A1 Novel Inhibitors of Glutaminyl Cyclase PROBIODRUG AG (DE) 2008-09-11 — — US disclosed
WO-2008055947-A1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2008-05-15 — — 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-20080221086-A1 Novel Inhibitors of Glutaminyl Cyclase GLS, GLS2, GLUL QPCT 9/4885ALDH1A1 1395/4885KDM4E 3591/4885

“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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