SCHEMBL29342194

SCHEMBL29342194

CC(C)C(=O)N[C@@H](I)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 2/20 0.30
MAPT P10636 1/20 0.30
CNR2 P34972 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
SCHEMBL29342171 1.00 MLYCD (0.35) MLYCDMEN1KMT2ALMNASMN1; SMN2
SCHEMBL16373133 0.78 MLYCD (0.36) MLYCDMEN1KMT2ALMNASMN1; SMN2
SCHEMBL16373136 0.78 MLYCD (0.36) MLYCDMEN1KMT2ALMNASMN1; SMN2
SCHEMBL25575538 0.78 MLYCD (0.36) MLYCDMEN1KMT2ALMNASMN1; SMN2
SCHEMBL19736334 0.78 MLYCD (0.36) MLYCDMEN1KMT2ALMNASMN1; SMN2
SCHEMBL29342180 0.74 MLYCD (0.34) MLYCDMEN1KMT2ALMNASMN1; SMN2
SCHEMBL23866608 0.71 PKM (0.42) MLYCDKMT2ASMN1; SMN2ALDH1A1
SCHEMBL29342172 0.71 TGFBR1 (0.41) L3MBTL1ALDH1A1
SCHEMBL19706645 0.71 MLYCD (0.33) MLYCDMEN1KMT2ALMNASMN1; SMN2
SCHEMBL19736332 0.70 CETP (0.33) MLYCDMEN1KMT2ALMNACNR2

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