SCHEMBL9844394

SCHEMBL9844394

O=C1OC(CCN2CCC3(CC2)C(=O)NCN3c2ccccc2)CN1c1ccc(F)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 6/20 0.61
OPRK1 P41145 5/20 0.61
CYP1A2 P05177 4/20 0.61
CYP2D6 P10635 4/20 0.61
DRD2 P14416 4/20 0.61
ADRA2B P18089 4/20 0.61
ADRA2C P18825 4/20 0.61
HTR2A P28223 4/20 0.61
ADRA1A P35348 4/20 0.61
DRD3 P35462 4/20 0.61
ADRB1 P08588 3/20 0.61
SLC6A4 P31645 3/20 0.61
HRH1 P35367 3/20 0.61
HTR2B P41595 3/20 0.61
HTR6 P50406 3/20 0.61
SLC6A3 Q01959 3/20 0.61
NR1I2 O75469 3/20 0.61
LMNA P02545 3/20 0.61
CYP3A4 P08684 3/20 0.61
CYP2C19 P33261 3/20 0.61

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
SCHEMBL9844492 0.94 OPRM1 (0.56) OPRM1OPRK1CYP1A2CYP2D6DRD2
SCHEMBL9844225 0.91 PLD2 (0.56) OPRM1OPRK1CYP1A2CYP2D6DRD2
SCHEMBL9844310 0.89 OPRM1 (0.57) OPRM1OPRK1CYP1A2CYP2D6DRD2
SCHEMBL9844276 0.86 GRM2 (0.51) OPRM1OPRK1CYP1A2CYP2D6DRD2
SCHEMBL9844116 0.85 PLD2 (0.53) OPRM1OPRK1CYP1A2CYP2D6DRD2
SCHEMBL9844431 0.85 OPRM1 (0.53) OPRM1OPRK1CYP1A2CYP2D6DRD2
SCHEMBL9677855 0.85 OPRM1 (0.67) OPRM1OPRK1CYP1A2CYP2D6DRD2
SCHEMBL9844265 0.84 OPRM1 (0.58) OPRM1OPRK1CYP1A2CYP2D6DRD2
SCHEMBL9844300 0.84 OPRM1 (0.52) OPRM1OPRK1CYP1A2CYP2D6DRD2
SCHEMBL9455222 0.81 OPRM1 (0.68) OPRM1OPRK1CYP1A2CYP2D6DRD2

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-0443197-A2 Oxazolidinones MERCK PATENT GmbH (DE) 1991-08-28 EP disclosed