SCHEMBL9844402

SCHEMBL9844402

COc1ccc(N2CC(CCN3CCCCC3Cc3ccccc3)OC2=O)cc1OC

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 11/20 0.44
SIGMAR1 Q99720 1/20 0.41
MAPK1 P28482 1/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
MCHR1 Q99705 1/20 0.39
PDE4B Q07343 1/20 0.38

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
SCHEMBL9677231 0.91 GRM2 (0.46) GRM2SIGMAR1MAPK1HTR2AHTR2C
SCHEMBL9844097 0.89 GRM2 (0.55) GRM2
SCHEMBL9844288 0.88 GRM2 (0.53) GRM2SIGMAR1
SCHEMBL9844243 0.86 GRM2 (0.42) GRM2SIGMAR1
SCHEMBL9844079 0.86 GRM2 (0.60) GRM2
SCHEMBL9844274 0.85 GRM2 (0.53) GRM2
SCHEMBL9844255 0.83 GRM2 (0.52) GRM2
SCHEMBL9844356 0.83 GRM2 (0.52) GRM2
SCHEMBL9844448 0.83 ABCB1 (0.55) GRM2
SCHEMBL9844309 0.82 CARM1 (0.45) GRM2SIGMAR1HTR2AHTR2CHTR2B

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