SCHEMBL3147012

SCHEMBL3147012

O=C(O)NCC1(COc2cnc(Cl)c(-c3ccccc3)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 5/20 0.44
CNR2 P34972 2/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA7 P36544 1/20 0.35
P2RX7 Q99572 1/20 0.35
PDK2 Q15119 1/20 0.34
GRM2 Q14416 1/20 0.34
RAB9A P51151 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
SCHEMBL3146674 0.92 CHRNB4 (0.43) FFAR4CHRNB4CHRNA3CHRNA7P2RX7
SCHEMBL3151357 0.92 ABL1 (0.42) FFAR4CHRNA7
SCHEMBL3147051 0.91 FFAR4 (0.38) FFAR4CHRNB4CHRNA3CHRNA7P2RX7
SCHEMBL3151015 0.91 FFAR4 (0.40) FFAR4CHRNB4CHRNA3CHRNA7P2RX7
SCHEMBL3256998 0.90 FFAR4 (0.42) FFAR4CHRNB4CHRNA3CHRNA7P2RX7
SCHEMBL3150641 0.90 P2RX7 (0.40) FFAR4CHRNB4CHRNA3CHRNA7P2RX7
SCHEMBL3147063 0.89 P2RX7 (0.44) FFAR4CHRNB4CHRNA3CHRNA7P2RX7
SCHEMBL3137042 0.89 NR3C1 (0.40) P2RX7
SCHEMBL3151266 0.87 FFAR4 (0.38) FFAR4CHRNB4CHRNA3CHRNA7P2RX7
SCHEMBL3151249 0.87 FFAR4 (0.38) FFAR4CHRNB4CHRNA3CHRNA7P2RX7

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