SCHEMBL7549147

SCHEMBL7549147

CC(=O)Oc1c(-c2ccc(F)cc2)nn(Cc2ccc(OCc3ccccc3)cc2)c1C

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 7/20 0.53
S1PR5 Q9H228 2/20 0.45
MAOB P27338 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KCNK3 O14649 1/20 0.43
FAAH O00519 1/20 0.43
MGLL Q99685 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
NR4A2 P43354 1/20 0.42
GPR34 Q9UPC5 1/20 0.42
PRKAA2 P54646 1/20 0.42
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41

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
SCHEMBL7564649 0.82 MAOB (0.45) PTGDR2S1PR5MAOBSMN1; SMN2HRH3
SCHEMBL5380988 0.74 MMP13 (0.49) PTGDR2SMN1; SMN2MEN1LMNAKMT2A
SCHEMBL5381126 0.73 PTGDR2 (0.48) PTGDR2S1PR5MAOBHRH3NR4A2
SCHEMBL7549149 0.72 GPR34 (0.43) PTGDR2S1PR5MAOBSMN1; SMN2KCNK3
SCHEMBL5381994 0.72 KMT2A (0.44) S1PR5MAOBSMN1; SMN2HRH3NR4A2
SCHEMBL5383039 0.71 GAA (0.68) MAOBSMN1; SMN2HRH3MEN1LMNA
SCHEMBL5383037 0.71 GAA (0.68) MAOBSMN1; SMN2HRH3MEN1LMNA
SCHEMBL2367511 0.71 MEN1 (0.60) PTGDR2SMN1; SMN2PRKAA2MEN1LMNA
SCHEMBL5381942 0.71 SMN1; SMN2 (0.58) PTGDR2MAOBSMN1; SMN2MEN1LMNA
SCHEMBL5372015 0.71 KMT2A (0.65) SMN1; SMN2MEN1LMNAKMT2A

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-1228067-A1 5-MEMBERED N-HETEROCYCLIC COMPOUNDS WITH HYPOGYLCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Chemical Industries, Ltd. (JP) 2002-08-07 EP disclosed
WO-2001038325-A1 5-MEMBERED N-HETEROCYCLIC COMPOUNDS WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-31 WO disclosed