SCHEMBL8801477

SCHEMBL8801477

Cc1ccc2cc(N3C[C@H](CO)OC3=O)sc2n1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.49
MAOB P27338 2/20 0.49
CALML3 P27482 6/20 0.41
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
USP25 Q9UHP3 2/20 0.33
GRM2 Q14416 2/20 0.33
USP28 Q96RU2 1/20 0.33

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
SCHEMBL79974 0.88 F10 (0.40) MAOAMAOBGRM2
SCHEMBL8802252 0.85 MAOA (0.52) MAOAMAOBCALML3CYP3A4CYP2C19
SCHEMBL8802639 0.84 MAOA (0.42) MAOAMAOBCALML3CYP3A4CYP2C19
SCHEMBL8802069 0.83 GRM2 (0.36) MAOAMAOBGRM2
SCHEMBL78334 0.80 F10 (0.60)
SCHEMBL8563892 0.76 MAOA (0.46) MAOAMAOBCALML3USP25GRM2
SCHEMBL8801479 0.76 MAOA (0.46) MAOAMAOBCALML3USP25GRM2
SCHEMBL9047627 0.75 MAOA (0.44) MAOAMAOBCALML3CYP3A4CYP2C19
SCHEMBL10881242 0.71 MAOA (0.56) MAOAMAOBCALML3GRM2
SCHEMBL6607536 0.71 MAOA (0.56) MAOAMAOBCALML3GRM2

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-0785200-A2 Pyridoannelated thienyl and furamyl-oxazolidinones BAYER AG (DE) 1997-07-23 EP disclosed