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SCHEMBL6918484

SCHEMBL6918484

CS(=O)(=O)OC[C@@H]1CN(c2ccc(C3=CCN(Cc4ccccc4)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 11/20 0.43
▸ CALML3 P27482 4/20 0.43
▸ MAOB P27338 1/20 0.40
▸ SIGMAR1 Q99720 1/20 0.39
▸ GRM2 Q14416 2/20 0.39

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
SCHEMBL5234671 1.00 MAOA (0.43) MAOACALML3MAOBSIGMAR1GRM2
SCHEMBL6918489 1.00 MAOA (0.43) MAOACALML3MAOBSIGMAR1GRM2
SCHEMBL4305527 0.90 GRM2 (0.40) MAOBSIGMAR1GRM2
SCHEMBL6924055 0.87 MAOA (0.43) MAOACALML3SIGMAR1
SCHEMBL5625330 0.86 CALML3 (0.58) MAOACALML3MAOB
SCHEMBL7256130 0.86 CALML3 (0.47) MAOACALML3GRM2
SCHEMBL4016280 0.86 CALML3 (0.47) MAOACALML3GRM2
SCHEMBL6925097 0.86 CALML3 (0.58) MAOACALML3MAOB
SCHEMBL5236580 0.86 CALML3 (0.58) MAOACALML3MAOB
SCHEMBL7256142 0.85 CALML3 (0.45) MAOACALML3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004113329-A1 OXAZOLE DERIVATIVES AS ANTIBACTERIAL AGENTS ORCHID CHEMICALS AND PHARMACEUTICALS LTD. (IN) 2004-12-29 — — WO disclosed
WO-2003097640-A1 OXAZOLIDINONE DERIVATIVES AS ANTIBACTERIAL AGENTS ORCHID CHEMICALS & PHARMACEUTICALS LTD. (IN) 2003-11-27 — — WO disclosed