SCHEMBL7466867

SCHEMBL7466867

CC(C(=O)O)c1oc(N2CCCC2)nc1-c1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.41
ADRA1A P35348 1/20 0.41
CNR1 P21554 6/20 0.41
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
DPP4 P27487 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
GABRA2 P47869 1/20 0.38
GABRB2 P47870 1/20 0.38
S1PR1 P21453 1/20 0.37
S1PR3 Q99500 1/20 0.37
S1PR5 Q9H228 1/20 0.37
THRB P10828 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL7456593 0.99 CNR1 (0.42) MAOAADRA1ACNR1POLBMAPK1
SCHEMBL7460620 0.91 KDM4E (0.46) MAOAADRA1ACNR1MAPK1
SCHEMBL7458952 0.84 MTOR (0.38) MAOAADRA1ACNR1DPP4DPP7
SCHEMBL7459960 0.79 MAOA (0.48) MAOAADRA1A
SCHEMBL10833843 0.78 MAOA (0.47) MAOAADRA1APOLB
SCHEMBL7468394 0.78 MAOA (0.42) MAOAADRA1ACNR1
SCHEMBL7461994 0.78 ALDH1A1 (0.42) MAOAADRA1APOLBMAPK1S1PR1
SCHEMBL7464622 0.78 MAOA (0.39) MAOAADRA1ACNR1TDP1
SCHEMBL6606357 0.77 MAOA (0.39) MAOAADRA1AS1PR1S1PR3S1PR5
SCHEMBL7459067 0.77 PDE4B (0.44) MAOAADRA1AL3MBTL1HSD17B10

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-6498179-B1 SUCH AS 4-(4-CHLOROPHENYL)-5-(3-(2-METHOXYPHENOXY)PROPYL)-2-(2-METHYL-1 -IMIDAZOLYL)OXAZOLE; INSULIN SECERTION PROMOTING AND BLOOD SUGAR DEPRESSING EFFECT; DIABETES; LOW TOXICITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-12-24 US disclosed
EP-0891340-B1 OXAZOLE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2002-11-13 EP disclosed
US-6177452-B1 ANTIDIABETIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-01-23 US disclosed