SCHEMBL714916

SCHEMBL714916

CN(C)C(=O)C1CCC(NC(=O)OC(C)(C)C)C(NC(=O)OCc2ccccc2)C1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CPB1 P15086 2/20 0.50
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
CYP3A4 P08684 2/20 0.48
TSHR P16473 2/20 0.48
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SYK P43405 1/20 0.43
LMNA P02545 1/20 0.43
CCR2 P41597 1/20 0.43
RAB9A P51151 1/20 0.42
KDM1A O60341 1/20 0.41
MAOB P27338 1/20 0.41
PDE4B Q07343 1/20 0.41
TACR1 P25103 2/20 0.41

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
SCHEMBL714915 1.00 CPB1 (0.50) CPB1ALDH1A1GAACYP3A4TSHR
SCHEMBL4094174 1.00 CPB1 (0.50) CPB1ALDH1A1GAACYP3A4TSHR
SCHEMBL713911 1.00 CPB1 (0.50) CPB1ALDH1A1GAACYP3A4TSHR
SCHEMBL715263 1.00 CPB1 (0.50) CPB1ALDH1A1GAACYP3A4TSHR
SCHEMBL717307 1.00 CPB1 (0.50) CPB1ALDH1A1GAACYP3A4TSHR
SCHEMBL715729 1.00 CPB1 (0.50) CPB1ALDH1A1GAACYP3A4TSHR
SCHEMBL4089080 1.00 CPB1 (0.50) CPB1ALDH1A1GAACYP3A4TSHR
SCHEMBL713910 1.00 CPB1 (0.50) CPB1ALDH1A1GAACYP3A4TSHR
SCHEMBL1504068 0.89 ALDH1A1 (0.58) CPB1ALDH1A1GAATSHRKMT2A
SCHEMBL10476662 0.89 ALDH1A1 (0.58) CPB1ALDH1A1GAATSHRKMT2A

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-20120053349-A1 OXAMIDE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-03-01 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-20120053349-A1 OXAMIDE DERIVATIVE SULT1E1, PKD2, PKD1 CPB1 2328/4885ALDH1A1 299/4885GAA 3639/4885

“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.