SCHEMBL7459189

SCHEMBL7459189

CC(C(=O)O)c1oc(NC2CCCCC2)nc1-c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.50
PLA2G1B P04054 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.40
ELANE P08246 1/20 0.40
ALOX5 P09917 1/20 0.39
MAOA P21397 1/20 0.39
ADRA1A P35348 1/20 0.39
POLB P06746 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL7461922 0.81 MAOA (0.44) NPC1RAB9APTGDR2MAOAADRA1A
SCHEMBL7459182 0.76 PLA2G1B (0.53) CNR1PLA2G1BATG4BNPC1RAB9A
SCHEMBL7459960 0.76 MAOA (0.48) NPC1RAB9APTGDR2MAOAADRA1A
SCHEMBL10833843 0.75 MAOA (0.47) NPC1RAB9APTGDR2MAOAADRA1A
SCHEMBL7456593 0.74 CNR1 (0.42) CNR1L3MBTL1MAOAADRA1APOLB
SCHEMBL7458952 0.74 MTOR (0.38) CNR1RAB9APTGDR2MAOAADRA1A
SCHEMBL7466867 0.73 MAOA (0.41) CNR1L3MBTL1MAOAADRA1APOLB
SCHEMBL7456936 0.72 MAOA (0.44) NPC1RAB9APTGDR2MAOAADRA1A
SCHEMBL10834263 0.72 MAOA (0.44) PTGDR2MAOAADRA1AKDM4E
SCHEMBL7463350 0.72 MAOA (0.44) NPC1RAB9APTGDR2MAOAADRA1A

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 5 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
EP-0891340-A1 OXAZOLE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1999-01-20 EP disclosed
WO-1997036882-A1 OXAZOLE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-10-09 WO disclosed