SCHEMBL16748121

SCHEMBL16748121

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)OCCBr

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ NPC1 O15118 1/20 0.46
▸ FKBP1A P62942 6/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ UCHL1 P09936 1/20 0.45
▸ KLK7 P49862 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ EPHX2 P34913 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43

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
SCHEMBL15911990 0.92 FKBP1A (0.49) HSD17B10SMN1; SMN2NPC1FKBP1AMEN1
SCHEMBL14135381 0.86 HSD17B10 (0.51) HSD17B10SMN1; SMN2NPC1FKBP1AMEN1
SCHEMBL8490085 0.86 HSD17B10 (0.51) HSD17B10SMN1; SMN2NPC1FKBP1AMEN1
SCHEMBL25736771 0.86 HSD17B10 (0.54) HSD17B10SMN1; SMN2NPC1FKBP1AMEN1
SCHEMBL12215284 0.85 FKBP1A (0.52) HSD17B10SMN1; SMN2NPC1FKBP1AMEN1
SCHEMBL18676059 0.85 FKBP1A (0.52) HSD17B10SMN1; SMN2NPC1FKBP1AMEN1
SCHEMBL25960272 0.85 FKBP1A (0.50) HSD17B10SMN1; SMN2NPC1FKBP1AMEN1
SCHEMBL1401256 0.85 FKBP1A (0.58) HSD17B10SMN1; SMN2NPC1FKBP1AMEN1
SCHEMBL440340 0.85 FKBP1A (0.58) HSD17B10SMN1; SMN2NPC1FKBP1AMEN1
SCHEMBL3206028 0.85 HSD17B10 (0.54) HSD17B10SMN1; SMN2NPC1FKBP1AMEN1

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
EP-2732874-B1 Method for synthesising heterogeneous solid chiral catalysts and their use in stereoselective reactions UNIV GUANAJUATO (MX) 2015-05-27 — — EP disclosed
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