SCHEMBL6996682

SCHEMBL6996682

CC(=O)NCC1CN(c2ccc(N3CCC(C(=O)O)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.78
MAOA P21397 5/20 0.78
PTGS1 P23219 2/20 0.78
SDHA P31040 2/20 0.78
LMNA P02545 1/20 0.78
CALML3 P27482 1/20 0.78
F10 P00742 8/20 0.58
ITGB3 P05106 1/20 0.56
PRSS1 P07477 1/20 0.56
PRSS2 P07478 1/20 0.56
ITGA2B P08514 1/20 0.56
PRSS3 P35030 1/20 0.56

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
SCHEMBL6994115 1.00 MAOB (0.78) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6992080 0.93 MAOB (0.79) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6992074 0.93 MAOB (0.79) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6991510 0.92 MAOB (0.76) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6991516 0.92 MAOB (0.76) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6993645 0.91 MAOB (0.75) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6993651 0.91 MAOB (0.75) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6191297 0.90 MAOB (0.80) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6995056 0.90 MAOB (0.80) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6995061 0.90 MAOB (0.80) MAOBMAOAPTGS1SDHALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0750618-B1 OXAZOLIDINONE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM UPJOHN CO (US) 2003-02-19 EP claimed
EP-0750618-B1 OXAZOLIDINONE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM UPJOHN CO (US) 2003-02-19 EP disclosed
US-5668286-A ANTIBIOTIC PHARMACIA & UPJOHN COMPANY (US) 1997-09-16 US disclosed