SCHEMBL29329050

SCHEMBL29329050

CC(C)NC(=O)CC(=O)NCCC(=O)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
FAAH O00519 1/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 5/20 0.38
ECE1 P42892 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
EPHX1 P07099 1/20 0.34
EPHX2 P34913 1/20 0.33
TSHR P16473 1/20 0.33
CYP1A2 P05177 2/20 0.33
POLB P06746 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HPGD P15428 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM3 P20309 1/20 0.33
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL29329063 0.84 ALDH1A1 (0.43) MEN1KMT2AFAAHALDH1A1ECE1
SCHEMBL29329056 0.82 ECE1 (0.39) MEN1KMT2AALDH1A1ECE1
SCHEMBL19199459 0.78 MEN1 (0.54) MEN1KMT2AALDH1A1CYP2C9
SCHEMBL22280196 0.77 MEN1 (0.52) MEN1KMT2AFAAHMAPK1ALDH1A1
SCHEMBL24398829 0.77 ALDH1A1 (0.38) MEN1KMT2AALDH1A1ECE1
SCHEMBL25443782 0.77 ALDH1A1 (0.38) MEN1KMT2AALDH1A1ECE1
SCHEMBL8909886 0.77 MEN1 (0.45) MEN1KMT2AFAAHMAPK1ALDH1A1
SCHEMBL13373640 0.77 FAAH (0.58) MEN1KMT2AFAAHMAPK1EPHX1
SCHEMBL13373705 0.76 RAB9A (0.43) MEN1KMT2AFAAHMAPK1ALDH1A1
SCHEMBL18866882 0.76 CASP2 (0.53) FAAHALDH1A1HPGD

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-12043833-B2 Targeted compositions ARBUTUS BIOPHARMA CORPORATION (CA) 2024-07-23 US disclosed