SCHEMBL7467486

SCHEMBL7467486

CC(C(=O)O)c1oc(Sc2nncn2-c2ccccc2)nc1-c1ccc(Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.35
MAOA P21397 1/20 0.35
ADRA1A P35348 1/20 0.35
FAAH O00519 1/20 0.35
KCNH2 Q12809 1/20 0.35
ALDH1A1 P00352 3/20 0.35
GABRA2 P47869 1/20 0.34
GABRB2 P47870 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 2/20 0.33
ACHE P22303 1/20 0.33
LIPE Q05469 1/20 0.33
MAPT P10636 1/20 0.33
MALT1 Q9UDY8 1/20 0.33
MAPK1 P28482 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
SCHEMBL7462764 0.86 ALDH1A1 (0.39) KMT2ASMN1; SMN2MAOAADRA1AALDH1A1
SCHEMBL7456546 0.85 ALDH1A1 (0.45) KMT2ASMN1; SMN2ALDH1A1MEN1MAPT
SCHEMBL7459166 0.81 MAOA (0.41) KMT2AMAOAADRA1AFAAHKCNH2
SCHEMBL7467471 0.79 RXRA (0.44) KMT2ASMN1; SMN2ADRA1AALDH1A1MEN1
SCHEMBL7453978 0.76 L3MBTL1 (0.41) KMT2ASMN1; SMN2MAOAADRA1AALDH1A1
SCHEMBL7463350 0.76 MAOA (0.44) KMT2AMAOAADRA1AALDH1A1ACHE
SCHEMBL7457919 0.75 MAOA (0.44) KMT2AMAOAADRA1AALDH1A1MAPT
SCHEMBL7462406 0.74 MAOA (0.40) SMN1; SMN2MAOAADRA1AFAAHKCNH2
SCHEMBL5210898 0.71 MAOA (0.53) SMN1; SMN2MAOAADRA1AFAAHKCNH2
SCHEMBL7459960 0.71 MAOA (0.48) MAOAADRA1A

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