SCHEMBL7833467

SCHEMBL7833467

CC(C)CCN1C(=O)NC(=O)C(C(=O)CC(C)C)C1=O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC25A5 P05141 1/20 0.39
SORT1 Q99523 3/20 0.35
CCKBR P32239 3/20 0.34
DAO P14920 1/20 0.33
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HTT P42858 1/20 0.31
TSHR P16473 2/20 0.31
LMNA P02545 2/20 0.30
MEN1 O00255 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 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
SCHEMBL7658136 0.81 SLC25A5 (0.42) SLC25A5SORT1CCKBRDAOALDH1A1
SCHEMBL5438951 0.72 GAA (0.35) SORT1CCKBRDAOALDH1A1GAA
SCHEMBL7656836 0.71 SLC25A5 (0.35) SLC25A5SORT1CCKBRALDH1A1GAA
SCHEMBL7664138 0.70 EP300 (0.53) SLC25A5CCKBRALDH1A1GAAHTT
SCHEMBL29414499 0.64 SLC25A5 (0.44) SLC25A5ALDH1A1HSD17B10LMNA
SCHEMBL7833468 0.64 LMNA (0.49) SLC25A5HSD17B10LMNA
SCHEMBL17841541 0.63 HSD17B10 (0.38) ALDH1A1GAAHSD17B10TSHRLMNA
SCHEMBL6967195 0.62 ALDH1A1 (0.43) ALDH1A1GAAHSD17B10LMNA
SCHEMBL7651075 0.61 EP300 (0.61) SLC25A5ALDH1A1GAAHTTMEN1
SCHEMBL1573209 0.60 SLC25A5 (0.47) SLC25A5ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1064269-A1 BARBITURIC ACID DERIVATIVE AND PREVENTIVE AND THERAPEUTIC AGENT FOR BONE AND CARTILAGE CONTAINING THE SAME Hoechst Marion Roussel (FR) 2001-01-03 EP disclosed
WO-1999050252-A2 BARBITURIC ACID DERIVATIVE AND PREVENTIVE AND THERAPEUTIC AGENT FOR BONE AND CARTILAGE CONTAINING THE SAME HOECHST MARION ROUSSEL (FR) 1999-10-07 WO disclosed