SCHEMBL8425149

SCHEMBL8425149

N#CCCC1Cc2cc(N)ccc2O1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 1/20 0.37
HRH3 Q9Y5N1 8/20 0.35
HRH4 Q9H3N8 1/20 0.35
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 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
SCHEMBL8425199 0.86 MAPKAPK2 (0.36) MAPKAPK2FFAR1FFAR4
SCHEMBL8026316 0.81 HRH3 (0.38) MAPKAPK2HRH3HRH4NPC1LMNA
SCHEMBL8425913 0.78 HRH3 (0.43) HRH3
SCHEMBL8426347 0.77 PNMT (0.38) NPC1LMNARAB9A
SCHEMBL7797531 0.77 GRM2 (0.45) HRH3HRH4
SCHEMBL7297669 0.76 HRH3 (0.38) MAPKAPK2HRH3HRH4NPC1LMNA
SCHEMBL7297674 0.76 HRH3 (0.38) MAPKAPK2HRH3HRH4NPC1LMNA
SCHEMBL8280054 0.76 HRH3 (0.38) MAPKAPK2HRH3HRH4NPC1LMNA
SCHEMBL18143171 0.76 MAPKAPK2 (0.30) MAPKAPK2
SCHEMBL16851328 0.76 MAPKAPK2 (0.30) MAPKAPK2

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-5925662-A OXIDASE INHIBITORS SYNTHELABO (FR) 1999-07-20 US disclosed
EP-0859776-A1 COMPOUNDS DERIVED FROM OXAZOLIDIN-2-ONE AND PREPARATION AND THERAPEUTICAL USE THEREOF SYNTHELABO (FR) 1998-08-26 EP disclosed
WO-1997017347-A1 COMPOUNDS DERIVED FROM OXAZOLIDIN-2-ONE AND PREPARATION AND THERAPEUTICAL USE THEREOF SYNTHELABO (FR) 1997-05-15 WO disclosed