SCHEMBL9844079

SCHEMBL9844079

O=C1OC(CCN2CCCCC2Cc2ccccc2)CN1c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 13/20 0.60
ATM Q13315 3/20 0.40
PIK3C3 Q8NEB9 3/20 0.40
ATR Q13535 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
PRKDC P78527 1/20 0.40

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
SCHEMBL9844255 0.93 GRM2 (0.52) GRM2
SCHEMBL9844356 0.93 GRM2 (0.52) GRM2ATM
SCHEMBL9844274 0.90 GRM2 (0.53) GRM2
SCHEMBL9844288 0.90 GRM2 (0.53) GRM2
SCHEMBL9677497 0.89 GRM2 (0.63) GRM2ATMPIK3C3ATRPRKDC
SCHEMBL9844097 0.89 GRM2 (0.55) GRM2ATM
SCHEMBL9844472 0.88 GRM2 (0.50) GRM2
SCHEMBL9844402 0.86 GRM2 (0.44) GRM2
SCHEMBL9844243 0.84 GRM2 (0.42) GRM2
SCHEMBL9677627 0.82 GRM2 (0.54) GRM2ATMPIK3C3ATRPRKDC

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