SCHEMBL10879438

SCHEMBL10879438

O=C1OC(CCl)CN1c1cc(C(F)F)cs1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CALML3 P27482 1/20 0.32
GRM2 Q14416 13/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
DAO P14920 1/20 0.31
GRIN1 Q05586 1/20 0.30
GRIN2B Q13224 1/20 0.30
F10 P00742 1/20 0.30

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
SCHEMBL11246885 0.80 MAOA (0.41) GRM2MAOAMAOB
SCHEMBL9425772 0.80 GRM2 (0.42) CALML3GRM2MAOAMAOBF10
SCHEMBL9425328 0.69 MAOA (0.41) CALML3GRM2MAOAMAOB
SCHEMBL9425927 0.68 GRM2 (0.43) CALML3GRM2MAOAMAOB
SCHEMBL6607536 0.67 MAOA (0.56) CALML3GRM2MAOAMAOB
SCHEMBL10881242 0.67 MAOA (0.56) CALML3GRM2MAOAMAOB
SCHEMBL11592601 0.65 GRM2 (0.60) GRM2
SCHEMBL10879427 0.65 GRM2 (0.44) GRM2F10
SCHEMBL7298956 0.64 GRM2 (0.69) GRM2F10
SCHEMBL10879568 0.64 GRM2 (0.43) GRM2F10

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-0050827-B1 3-(P-ALKYLSULFONYLPHENYL)-AND 3-(P-ALKYLSULFINYLPHENYL)OXAZOLIDINONE DERIVATIVES AS ANTI-BACTERIAL AGENTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1986-04-30 EP disclosed