SCHEMBL6313794

SCHEMBL6313794

O=C(O)CCNC(=O)C1CCOC1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.41
DRD2 P14416 3/20 0.41
DRD4 P21917 3/20 0.41
ITGB3 P05106 13/20 0.39
ITGA2B P08514 13/20 0.39
F2R P25116 9/20 0.39
GLS O94925 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HTT P42858 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
SCHEMBL20928257 0.81 CHRNB2 (0.47) HTR1ADRD2DRD4GLSKDM4E
SCHEMBL3663509 0.78 GLS (0.41) HTR1ADRD2DRD4GLS
SCHEMBL29306574 0.78 NAAA (0.53) HTR1ADRD2DRD4KDM4EHTT
SCHEMBL13702331 0.77 HTR1A (0.41) HTR1ADRD2DRD4GLSKDM4E
SCHEMBL47362 0.77 GLS (0.40) HTR1ADRD2DRD4GLS
SCHEMBL16768104 0.76 HTR1A (0.45) HTR1ADRD2DRD4
SCHEMBL3199095 0.76 NAAA (0.53) ITGB3ITGA2BF2R
SCHEMBL10499072 0.75 HTR1A (0.44) HTR1ADRD2DRD4ITGB3ITGA2B
SCHEMBL24654177 0.74 HSD17B10 (0.43) HTR1ADRD2DRD4HTT
SCHEMBL12999518 0.74 ITGB3 (0.43) ITGB3ITGA2BF2RKDM4EHTT

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 HTR1A 270/4885DRD2 1175/4885DRD4 856/4885

“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.