SCHEMBL7710057

SCHEMBL7710057

CC(=O)NC[C@H]1CN(c2cc(F)c(C(C)=O)c(F)c2)C(=O)O1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.64
MAOB P27338 3/20 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 5/20 0.49

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
SCHEMBL5839206 0.92 MAOA (0.63) MAOAMAOBPTGS1SDHALMNA
SCHEMBL14769666 0.89 MAOA (0.66) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5837775 0.89 MAOA (0.66) MAOAMAOBPTGS1SDHALMNA
SCHEMBL3370358 0.89 MAOA (0.66) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7712722 0.89 MAOA (0.60) MAOAMAOBPTGS1SDHALMNA
SCHEMBL2891482 0.88 MAOA (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8590619 0.88 MAOA (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL18770289 0.88 MAOA (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL18770260 0.88 MAOA (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL3187054 0.88 MAOA (0.64) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6362191-B1 ANTIBIOTICS ZENECA LTD. (GB) 2002-03-26 US disclosed
EP-1007525-A1 AMINOMETYL OXOOXAZOLIDINYL BENZENE DERIVATIVES ZENECA LIMITED (GB) 2000-06-14 EP disclosed
WO-1999011642-A1 AMINOMETYL OXOOXAZOLIDINYL BENZENE DERIVATIVES ZENECA LIMITED (GB) 1999-03-11 WO disclosed