SCHEMBL7464609

SCHEMBL7464609

O=C(O)CCc1oc(-n2ccnc2)nc1-c1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXRA P19793 6/20 0.46
RXRB P28702 6/20 0.46
RXRG P48443 4/20 0.46
TBXAS1 P24557 5/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41
GFER P55789 1/20 0.41
NOTUM Q6P988 1/20 0.39
ADH5 P11766 1/20 0.39
LMNA P02545 1/20 0.38
CD38 P28907 1/20 0.38
NR4A2 P43354 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
SCHEMBL5211444 0.87 CYP11B1 (0.42) RXRARXRBRXRGALDH1A1HPGD
SCHEMBL7457881 0.86 KDM4E (0.45) TSHRALDH1A1HPGDKDM4EMAPT
SCHEMBL7459279 0.85 PKM (0.38) TSHRMAPTPKMNOTUMLMNA
SCHEMBL1361930 0.84 NOTUM (0.40) NOTUMADH5CD38
SCHEMBL7461986 0.80 RXRA (0.46) RXRARXRBRXRGTSHRALDH1A1
SCHEMBL7468386 0.80 RXRA (0.48) RXRARXRBRXRGTSHRALDH1A1
SCHEMBL7459313 0.78 NOTUM (0.37) ALDH1A1MAPTNOTUMLMNACD38
SCHEMBL6606347 0.78 RXRA (0.47) RXRARXRBRXRGTSHRALDH1A1
SCHEMBL7466864 0.78 RXRA (0.48) RXRARXRBRXRGTSHRALDH1A1
SCHEMBL5207078 0.78 CHRM1 (0.37) ALDH1A1HPGDMAPTHTTLMNA

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