SCHEMBL8315133

SCHEMBL8315133

CC(C)(C)OC(=O)OC1CCCCN1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
EPHX1 P07099 2/20 0.33
HPGD P15428 1/20 0.31
CCR2 P41597 1/20 0.31
BTK Q06187 1/20 0.31
FDPS P14324 2/20 0.31
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
SLC6A3 Q01959 3/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
DHFR P00374 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
SCHEMBL8315816 0.95 MEN1 (0.32) GAAEPHX1HPGDBTKCHRM2
SCHEMBL3694198 0.81 GABRP (0.31) CHRM2CHRM1CHRM3
SCHEMBL9998422 0.81 EPHX1 (0.36) EPHX1FDPSCHRM2CHRM1CHRM3
SCHEMBL9685631 0.79 SLC6A3 (0.42) SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL11166441 0.79 GLI1 (0.38)
Ammonia Solution, Strong SCHEMBL16191692 0.79 EPHX1 (0.35) EPHX1FDPSCHRM2CHRM1CHRM3
Hydrochloric Acid SCHEMBL8933166 0.78 SLC6A3 (0.43) SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL29291158 0.77
SCHEMBL7590352 0.77
SCHEMBL27508951 0.76 MEN1 (0.40)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623615-B1 Substituted 1-phenyl-oxazolidin-2-one derivatives, their preparation and their use as adhesion-receptor antagonists MERCK PATENT GMBH (DE) 1999-06-30 EP disclosed
EP-0623615-A1 Adhesion-receptor antagonists MERCK PATENT GmbH (DE) 1994-11-09 EP disclosed