SCHEMBL9844084

SCHEMBL9844084

COc1cccc(N2CC(CCN3CCC(Cc4ccccc4)CC3)OC2=O)c1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 5/20 0.57
HTR1A P08908 1/20 0.56
SLC6A4 P31645 1/20 0.56
CCR3 P51677 3/20 0.50
HTR2A P28223 1/20 0.49
HTR7 P34969 1/20 0.48
GAA P10253 1/20 0.47

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
SCHEMBL9678329 0.90 GRM2 (0.58) GRM2HTR1ASLC6A4CCR3GAA
SCHEMBL9844291 0.90 GRM2 (0.55) GRM2
SCHEMBL9844422 0.90 GRM2 (0.55) GRM2HTR1ASLC6A4CCR3HTR2A
Hydrochloric Acid SCHEMBL9844260 0.90 GRM2 (0.54) GRM2
SCHEMBL9844119 0.89 GRM2 (0.56) GRM2SLC6A4
SCHEMBL9844101 0.88 GRM2 (0.64) GRM2SLC6A4CCR3
SCHEMBL9844448 0.88 ABCB1 (0.55) GRM2SLC6A4
SCHEMBL9844426 0.84 GRM2 (0.52) GRM2HTR1ASLC6A4CCR3HTR2A
SCHEMBL6416989 0.84 HTR1A (0.60) GRM2HTR1ASLC6A4
SCHEMBL9844336 0.83 GRM2 (0.56) GRM2HTR2AHTR7

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