SCHEMBL7466864

SCHEMBL7466864

O=C(O)CCc1oc(N2CCCC2)nc1-c1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 8/20 0.48
RXRB P28702 8/20 0.48
RXRG P48443 6/20 0.48
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
GFER P55789 1/20 0.46
TSHR P16473 2/20 0.43
CNR1 P21554 2/20 0.41
PTGES O14684 1/20 0.40
NR4A2 P43354 2/20 0.40
POLB P06746 2/20 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
APEX1 P27695 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
SCHEMBL7456584 0.99 RXRA (0.47) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL7463596 0.99 RXRA (0.47) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL7460612 0.91 RXRA (0.46) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL5212267 0.90 RXRA (0.46) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL5211309 0.89 RXRA (0.50) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL7458941 0.83 RXRA (0.42) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL5212222 0.81 NPC1 (0.45) KDM4EALDH1A1MAPTHTTCNR1
SCHEMBL5214150 0.80 KMT2A (0.43) RXRARXRBRXRGALDH1A1MAPT
SCHEMBL5208589 0.79 RXRA (0.56) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL7468386 0.78 RXRA (0.48) RXRARXRBRXRGKDM4EALDH1A1

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