SCHEMBL25790926

SCHEMBL25790926

CC(C)CCCNC(=O)C(C)(C)CCOC(C)(C)CNC(=O)CC(C)C

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
CNR1 P21554 1/20 0.30
MEN1 O00255 1/20 0.30
GAA P10253 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
SCHEMBL23169030 0.80 TSHR (0.33) SMN1; SMN2ALDH1A1HPGDCNR1GAA
SCHEMBL22923593 0.77 MEN1 (0.41) KMT2AHPGDCNR1MEN1
SCHEMBL25851494 0.75 CCR2 (0.32) ALDH1A1
SCHEMBL24855536 0.75 ALDH1A1 (0.33) TP53SMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL24264728 0.74 TP53 (0.31) TP53SMN1; SMN2HPGDGAA
SCHEMBL24920323 0.74
SCHEMBL22923591 0.74 CASP2 (0.41) SMN1; SMN2KMT2AALDH1A1HPGDCNR1
SCHEMBL24709963 0.73 TP53 (0.41) TP53SMN1; SMN2KMT2AALDH1A1HPGD
SCHEMBL25791933 0.72 KDM4E (0.32) ALDH1A1CNR1
SCHEMBL24654075 0.72 PTGS1 (0.39) TP53SMN1; SMN2KMT2AALDH1A1CNR1

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-2023122298-A1 PROTEIN STABILIZING COMPOUNDS CONTAINING USP28 AND/OR USP25 TARGETING LIGANDS Stablix, Inc. (US) 2023-06-29 WO disclosed