SCHEMBL6080484

SCHEMBL6080484

CCOC(=O)C(C)(C)Oc1ccc(CC(=O)NC(CC(C)C)c2cc(Cl)ccc2N2CCCCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.53
ABCC8 Q09428 3/20 0.53
ABCB11 O95342 2/20 0.53
HTR2A P28223 2/20 0.53
LMNA P02545 2/20 0.53
SLC22A1 O15245 1/20 0.53
ABCC3 O15438 1/20 0.53
ABCC4 O15439 1/20 0.53
NR1I2 O75469 1/20 0.53
ADORA3 P0DMS8 1/20 0.53
MAPK1 P28482 1/20 0.53
ADRA1A P35348 1/20 0.53
PTGS2 P35354 1/20 0.53
PDE4D Q08499 1/20 0.53
NR1I3 Q14994 1/20 0.53
ABCC2 Q92887 1/20 0.53
NR1H4 Q96RI1 1/20 0.53
MC4R P32245 12/20 0.47
MC5R P33032 4/20 0.47
MC3R P41968 4/20 0.47

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
SCHEMBL6081074 0.90 ABCC8 (0.53) CYP3A4ABCC8ABCB11HTR2ALMNA
SCHEMBL6081218 0.90 CYP3A4 (0.53) CYP3A4ABCC8ABCB11HTR2ALMNA
SCHEMBL6080539 0.88 ABCC8 (0.64) CYP3A4ABCC8ABCB11HTR2ALMNA
SCHEMBL6080962 0.88 ABCC8 (0.63) CYP3A4ABCC8ABCB11HTR2ALMNA
SCHEMBL6081412 0.84 ABCC8 (0.51) CYP3A4ABCC8ABCB11HTR2ALMNA
SCHEMBL6080988 0.83 ABCC8 (0.56) CYP3A4ABCC8ABCB11HTR2ALMNA
SCHEMBL6080947 0.82 CYP3A4 (0.63) CYP3A4ABCC8ABCB11HTR2ALMNA
SCHEMBL6080796 0.81 CNR2 (0.47) CYP3A4ABCC8ABCB11HTR2ALMNA
SCHEMBL6081182 0.81 LMNA (0.55) CYP3A4ABCC8ABCB11HTR2ALMNA
SCHEMBL6080924 0.81 ABCC8 (0.62) CYP3A4ABCC8ABCB11HTR2ALMNA

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-20060079696-A1 Substituted compounds derived from N-(benzyl)phenylacetamide, preparation and uses GENFIT (FR) 2006-04-13 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-20060079696-A1 Substituted compounds derived from N-(benzyl)phenylacetamide, preparation and uses AADAC, NAT1, PARN CYP3A4 208/4885ABCC8 567/4885ABCB11 70/4885

“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.