SCHEMBL6313513

SCHEMBL6313513

CCOC(=O)CCCNC(=O)c1cccc(C=O)c1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.55
▸ CYP2C19 P33261 2/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ ALDH1A1 P00352 2/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ NPC1 O15118 1/20 0.53
▸ MAPT P10636 2/20 0.51
▸ HSP90AA1 P07900 2/20 0.49
▸ PDE5A O76074 1/20 0.48
▸ USP2 O75604 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ NAMPT P43490 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ LMNA P02545 2/20 0.45
▸ HTT P42858 1/20 0.45

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
SCHEMBL15156200 0.84 SMN1; SMN2 (0.55) SMN1; SMN2ALDH1A1KDM4ENPC1MAPT
SCHEMBL11410724 0.84 SMN1; SMN2 (0.61) CYP3A4CYP2C19CYP1A2SMN1; SMN2ALDH1A1
SCHEMBL14172936 0.84 PDE5A (0.59) CYP3A4CYP2C19CYP1A2SMN1; SMN2ALDH1A1
SCHEMBL5009820 0.83 MAPT (0.62) CYP3A4CYP2C19CYP1A2SMN1; SMN2ALDH1A1
SCHEMBL4442984 0.82 HSP90AA1 (0.57) CYP3A4CYP2C19CYP1A2SMN1; SMN2ALDH1A1
SCHEMBL13330092 0.81 CYP1A2 (0.57) CYP3A4CYP2C19CYP1A2SMN1; SMN2ALDH1A1
SCHEMBL15400405 0.81 CYP3A4 (0.68) CYP3A4CYP2C19CYP1A2SMN1; SMN2ALDH1A1
SCHEMBL18918544 0.81 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1NPC1MAPTLMNA
SCHEMBL23223762 0.80 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1NPC1MAPTLMNA
SCHEMBL2276760 0.79 HPGD (0.56) SMN1; SMN2ALDH1A1HPGDMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014810-A1 Use of substituted 2 phenylbenzimidazoles as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-01-20 — — 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 (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-20050014810-A1 Use of substituted 2 phenylbenzimidazoles as medicaments GLP1R, GIPR, GCGR CYP3A4 439/4885CYP2C19 462/4885CYP1A2 624/4885

“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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