SCHEMBL7463535

SCHEMBL7463535

Cc1ncn(-c2nc(-c3ccc(Cl)cc3)c(CCC(=O)O)o2)c1C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXRA P19793 7/20 0.44
RXRB P28702 7/20 0.44
RXRG P48443 4/20 0.44
TSHR P16473 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
GFER P55789 1/20 0.39
FFAR4 Q5NUL3 9/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.37
NR4A2 P43354 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
SCHEMBL5212321 0.91 RXRA (0.34) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL6606347 0.83 RXRA (0.47) RXRARXRBRXRGTSHRKDM4E
SCHEMBL5211552 0.83 RXRA (0.42) RXRARXRBRXRGTSHRKDM4E
SCHEMBL5213384 0.81 RXRA (0.47) RXRARXRBRXRGTSHRKDM4E
SCHEMBL5213719 0.80 RXRA (0.54) RXRARXRBRXRGTSHRKDM4E
SCHEMBL7468221 0.79 RXRA (0.50) RXRARXRBRXRGTSHRKDM4E
SCHEMBL7453572 0.79 RXRA (0.43) RXRARXRBRXRGTSHRKDM4E
SCHEMBL7462798 0.78 RXRA (0.42) RXRARXRBRXRGTSHRKDM4E
SCHEMBL7462922 0.78 RXRA (0.42) RXRARXRBRXRGTSHRKDM4E
SCHEMBL5208221 0.78 RXRA (0.43) RXRARXRBRXRGTSHRKDM4E

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