SCHEMBL9844448

SCHEMBL9844448

COc1ccc(N2CC(CCN3CCC(Cc4ccccc4)CC3)OC2=O)cc1OC

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.55
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
GRM2 Q14416 1/20 0.47
THRB P10828 1/20 0.46
POLB P06746 1/20 0.45

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
SCHEMBL9678951 0.91 SIGMAR1 (0.54) ABCB1MEN1KMT2AGRM2THRB
SCHEMBL9844309 0.90 CARM1 (0.45) ABCB1MEN1KMT2AKDM4EALDH1A1
SCHEMBL9844084 0.88 GRM2 (0.57) SLC6A4GRM2
SCHEMBL9844291 0.88 GRM2 (0.55) GRM2
Hydrochloric Acid SCHEMBL9844260 0.87 GRM2 (0.54) GRM2
SCHEMBL9844082 0.86 SLC6A2 (0.60) ABCB1MEN1KMT2AKDM4EALDH1A1
SCHEMBL9844101 0.85 GRM2 (0.64) SLC6A2SLC6A4GRM2
SCHEMBL9844119 0.84 GRM2 (0.56) SLC6A2SLC6A4GRM2
SCHEMBL9844433 0.84 SIGMAR1 (0.45) KMT2AGRM2
SCHEMBL9844402 0.83 GRM2 (0.44) GRM2

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