SCHEMBL11276382

SCHEMBL11276382

CCOC(=O)N1CCC2(CC1)OC(=O)CC2c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.47
APP P05067 4/20 0.44
NPC1 O15118 1/20 0.44
GAA P10253 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL11275319 0.79 CHRM1 (0.43) BRD4SMN1; SMN2TSHRKMT2A
SCHEMBL12835956 0.78 DRD2 (0.47) KMT2A
SCHEMBL11273632 0.72 RORC (0.40) ALDH1A1
SCHEMBL17583802 0.72 GAA (0.52) GAASMN1; SMN2L3MBTL1TSHRKMT2A
SCHEMBL17732414 0.72 GAA (0.52) GAASMN1; SMN2L3MBTL1TSHRKMT2A
SCHEMBL17589052 0.72 GAA (0.52) GAASMN1; SMN2L3MBTL1TSHRKMT2A
SCHEMBL7435969 0.71 L3MBTL1 (0.51) APPGAASMN1; SMN2L3MBTL1MAPT
SCHEMBL21581202 0.70 OPRD1 (0.63) APPMAPTTSHR
SCHEMBL16182201 0.70 OPRD1 (0.40) SMN1; SMN2ALDH1A1
SCHEMBL11860423 0.69 SIGMAR1 (0.54) BRD4APPMAPTTSHRPOLB

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-4321379-A NEUROLEPTIC AGENTS AND ANALGESICS AMERICAN CYANAMID COMPANY (US) 1982-03-23 US disclosed