SCHEMBL29342177

SCHEMBL29342177

C=C(NC(=O)C(C)C)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CETP P11597 1/20 0.32
GAA P10253 2/20 0.31
ALDH1A1 P00352 3/20 0.31
LMNA P02545 1/20 0.31
KDM4E B2RXH2 1/20 0.31
RECQL P46063 1/20 0.31
MDM4 O15151 1/20 0.30
TP53 P04637 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
SCHEMBL2775 0.78 GAA (0.37) CETPGAAALDH1A1LMNAKDM4E
SCHEMBL28471189 0.78
SCHEMBL2608298 0.78
SCHEMBL12322156 0.74 ALDH1A1 (0.35) ALDH1A1LMNA
SCHEMBL15274732 0.74
SCHEMBL11229697 0.74 GAA (0.33) GAAALDH1A1
SCHEMBL2930591 0.74 RXFP1 (0.38) ALDH1A1KDM4E
SCHEMBL28347670 0.73 GAA (0.34) CETPGAAALDH1A1LMNAKDM4E
SCHEMBL15080637 0.72 TDP1 (0.38)
SCHEMBL24358298 0.71

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
WO-2024151519-A2 PPARG MODULATORS UNIVERSITY OF FLORIDA RESEARCH FOUNDATIN, INCORPORATED (US) 2024-07-18 WO disclosed