SCHEMBL7834046

SCHEMBL7834046

COC(=O)N1CCCC2CN(c3ccc(N4CC(CNC(C)=O)OC4=O)cc3F)C[C@@H]21

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.64
MAOB P27338 5/20 0.64
PTGS1 P23219 2/20 0.64
SDHA P31040 2/20 0.64
LMNA P02545 1/20 0.64
CALML3 P27482 1/20 0.64
F10 P00742 8/20 0.51

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
SCHEMBL7821834 1.00 MAOA (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7821827 1.00 MAOA (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7821832 1.00 MAOA (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7832542 1.00 MAOA (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7834627 0.92 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7832397 0.92 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7832390 0.92 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7832394 0.92 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7834625 0.92 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7834519 0.91 MAOA (0.66) MAOAMAOBPTGS1SDHALMNA

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
EP-0828741-B1 SPIROCYCLIC AND BICYCLIC DIAZINYL AND CARBAZINYL OXAZOLIDINONES UPJOHN CO (US) 2001-08-29 EP disclosed
US-6090820-A MICROBIOCIDES, BATERICIDES PHARMACIA & UPJOHN COMPANY (US) 2000-07-18 US disclosed