SCHEMBL9844055

SCHEMBL9844055

O=C(c1ccccc1)C1CCN(CCC2CN(c3ccc(Cl)cc3)C(=O)O2)CC1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 9/20 0.49
HTR2A P28223 2/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MGLL Q99685 1/20 0.47
KCNH2 Q12809 2/20 0.46
HTR7 P34969 1/20 0.46
F10 P00742 1/20 0.44
LMNA P02545 1/20 0.43
HTR1A P08908 1/20 0.43

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
SCHEMBL9844499 0.93 HTR2A (0.53) GRM2HTR2AMEN1KMT2AKCNH2
SCHEMBL9844242 0.90 HTR2A (0.52) GRM2HTR2AHTR7
SCHEMBL9678985 0.90 SIGMAR1 (0.52) GRM2HTR2AMEN1KMT2AMGLL
SCHEMBL9844329 0.87 SIGMAR1 (0.54) GRM2HTR2AMEN1KMT2AKCNH2
SCHEMBL9844308 0.83 MAOA (0.56) GRM2HTR2AMEN1KMT2AKCNH2
SCHEMBL9844433 0.83 SIGMAR1 (0.45) GRM2HTR2AKMT2AKCNH2
SCHEMBL9844336 0.82 GRM2 (0.56) GRM2HTR2AMGLLKCNH2HTR7
SCHEMBL9677080 0.82 MEN1 (0.52) GRM2HTR2AMEN1KMT2AKCNH2
SCHEMBL9844385 0.82 SLC6A2 (0.58) GRM2
SCHEMBL9844338 0.81 GRM2 (0.51) GRM2HTR2AMEN1KMT2AMGLL

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