SCHEMBL29342180

SCHEMBL29342180

CC(C)C(=O)NC(C(C)C)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GSK3B P49841 1/20 0.31
DYRK1A Q13627 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 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
SCHEMBL7940721 0.81 DPP4 (0.35) MEN1KMT2ASMN1; SMN2L3MBTL1CYP2C9
SCHEMBL801237 0.79 ALDH1A1 (0.34) SMN1; SMN2
SCHEMBL801063 0.79 ALDH1A1 (0.34) SMN1; SMN2
SCHEMBL16373136 0.76 MLYCD (0.36) MLYCDMEN1KMT2ALMNASMN1; SMN2
SCHEMBL25575538 0.76 MLYCD (0.36) MLYCDMEN1KMT2ALMNASMN1; SMN2
SCHEMBL16373133 0.76 MLYCD (0.36) MLYCDMEN1KMT2ALMNASMN1; SMN2
SCHEMBL19736334 0.76 MLYCD (0.36) MLYCDMEN1KMT2ALMNASMN1; SMN2
SCHEMBL29342171 0.74 MLYCD (0.35) MLYCDMEN1KMT2ALMNASMN1; SMN2
SCHEMBL29342194 0.74 MLYCD (0.35) MLYCDMEN1KMT2ALMNASMN1; SMN2
SCHEMBL26658582 0.72 CACNA1I (0.31) KMT2ASMN1; SMN2

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