SCHEMBL9844082

SCHEMBL9844082

COc1ccccc1N1CC(CCN2CCC(Cc3ccccc3)CC2)OC1=O

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.60
SLC6A4 P31645 1/20 0.60
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 1/20 0.48
HTR7 P34969 2/20 0.48
ABCB1 P08183 1/20 0.48
NPSR1 Q6W5P4 1/20 0.47
SIGMAR1 Q99720 1/20 0.46
PRMT3 O60678 1/20 0.46
CARM1 Q86X55 1/20 0.46
PRMT6 Q96LA8 1/20 0.46
PRMT1 Q99873 1/20 0.46
PRMT8 Q9NR22 1/20 0.46
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
MAPK14 Q16539 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
SCHEMBL9678759 0.90 SLC6A2 (0.57) SLC6A2SLC6A4MEN1KMT2AKDM4E
SCHEMBL9844023 0.90 SLC6A2 (0.48) SLC6A2SLC6A4MEN1KMT2AKDM4E
SCHEMBL9844448 0.86 ABCB1 (0.55) SLC6A2SLC6A4MEN1KMT2AKDM4E
SCHEMBL9844291 0.84 GRM2 (0.55) SIGMAR1
Hydrochloric Acid SCHEMBL9844260 0.83 GRM2 (0.54) SIGMAR1
SCHEMBL9844101 0.83 GRM2 (0.64) SLC6A2SLC6A4SIGMAR1PRMT3CARM1
SCHEMBL9844167 0.83 HTR7 (0.46) KMT2AHTR7CYP2C19
SCHEMBL9844084 0.83 GRM2 (0.57) SLC6A4HTR7
SCHEMBL9844243 0.82 GRM2 (0.42) SLC6A2SLC6A4HTR7SIGMAR1
SCHEMBL9676935 0.82 SLC6A2 (0.47) SLC6A2SLC6A4MEN1KMT2ASIGMAR1

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