SCHEMBL9795141

SCHEMBL9795141

CC(C)(CNC(=O)C(C)(C)N)COC(=O)C(=O)OCC(C)(C)CNC(=O)C(C)(C)N

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TSHR P16473 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
SCHEMBL21907142 0.87 HSD17B10 (0.31) SMN1; SMN2HSD17B10
SCHEMBL9795545 0.78 SMYD3 (0.33) SMN1; SMN2HSD17B10
SCHEMBL2746180 0.76 SMN1; SMN2 (0.34) SMN1; SMN2HSD17B10TSHR
SCHEMBL9497924 0.76 ALDH1A1 (0.38)
SCHEMBL9795151 0.75 KDM4E (0.33) HSD17B10
SCHEMBL9795486 0.74
SCHEMBL15081428 0.74
SCHEMBL26783485 0.73 BCHE (0.36)
SCHEMBL9795370 0.73 IDO1 (0.33) SMN1; SMN2
SCHEMBL9795332 0.73

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-5037849-A For treatment of heart and circulatory diseases BOEHRINGER MANNHEIM GMBH (DE) 1991-08-06 US disclosed