SCHEMBL9844211

SCHEMBL9844211

O=C1OC(CCN2CCC(Cc3ccccc3)CC2)CN1c1ccc(F)cc1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.55
SLC6A2 P23975 3/20 0.48
SLC6A4 P31645 3/20 0.48
SLC6A3 Q01959 1/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48
CCR3 P51677 4/20 0.47
OPRM1 P35372 1/20 0.46

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
SCHEMBL9844101 0.92 GRM2 (0.64) GRM2SLC6A2SLC6A4CCR3
SCHEMBL9844131 0.90 GRM2 (0.55) GRM2SLC6A2SLC6A4CCR3
SCHEMBL9844385 0.90 SLC6A2 (0.58) GRM2SLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL9676204 0.89 GRM2 (0.57) GRM2KDM4EALDH1A1MAPT
SCHEMBL9844281 0.89 GRM2 (0.52) GRM2KDM4EALDH1A1MAPTCCR3
Hydrochloric Acid SCHEMBL9679291 0.88 GRM2 (0.56) GRM2KDM4EALDH1A1MAPT
SCHEMBL9844291 0.87 GRM2 (0.55) GRM2OPRM1
Hydrochloric Acid SCHEMBL9844260 0.86 GRM2 (0.54) GRM2OPRM1
SCHEMBL7528602 0.84 SIGMAR1 (0.53) GRM2
SCHEMBL9844119 0.83 GRM2 (0.56) GRM2SLC6A2SLC6A4

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