SCHEMBL3156100

SCHEMBL3156100

CN(C(=O)O)C1(COc2cnc(F)c(Br)c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP4A11 Q02928 3/20 0.35
CYP4F2 P78329 2/20 0.35
P2RX3 P56373 1/20 0.33
P2RX2 Q9UBL9 1/20 0.33
PDK2 Q15119 2/20 0.31

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
SCHEMBL3151319 0.85
SCHEMBL3151484 0.80 CHRNB2 (0.38)
SCHEMBL3150873 0.80 CYP11B1 (0.35) CYP4A11CYP4F2
SCHEMBL3155887 0.79 FFAR4 (0.36)
SCHEMBL3137211 0.79 FFAR4 (0.38)
SCHEMBL3138316 0.77 KDM1A (0.41)
SCHEMBL3151485 0.77 SLC6A9 (0.37)
SCHEMBL3773306 0.76 CYP4A11 (0.32) CYP4A11CYP4F2
SCHEMBL3151351 0.75 PTGDR2 (0.38)
SCHEMBL6482943 0.74 CYP4F2 (0.39) CYP4A11CYP4F2

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-1979321-B9 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2010-02-17 EP disclosed
EP-1979321-B1 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2009-07-29 EP disclosed