SCHEMBL1362566

SCHEMBL1362566

Cc1nccn1-c1nc(-c2ccc(Cl)c(Cl)c2)c(CCCO)o1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.36
EPHX2 P34913 1/20 0.36
PTGS2 P35354 1/20 0.36
ADH5 P11766 1/20 0.35
RXRA P19793 2/20 0.35
RXRB P28702 2/20 0.35
RXRG P48443 2/20 0.35
KMO O15229 1/20 0.32
TLR8 Q9NR97 1/20 0.32
KCNH2 Q12809 3/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2D6 P10635 2/20 0.32
GPR142 Q7Z601 2/20 0.32
CACNA1C Q13936 1/20 0.32
SCN5A Q14524 1/20 0.32
GRM2 Q14416 2/20 0.31
SIRT2 Q8IXJ6 1/20 0.31
HSD11B1 P28845 1/20 0.31
BRAF P15056 1/20 0.31
PDE4A P27815 1/20 0.31

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
SCHEMBL963990 0.88 SIRT2 (0.40) ADH5RXRARXRBRXRGKCNH2
SCHEMBL7508759 0.86 RXRA (0.49) PTGS1EPHX2PTGS2RXRARXRB
SCHEMBL965656 0.85 SIRT2 (0.37) ADH5RXRARXRBRXRGKCNH2
SCHEMBL964061 0.84 SIRT2 (0.36) ADH5RXRARXRBRXRGKCNH2
SCHEMBL1360344 0.84 SIRT2 (0.36) ADH5RXRARXRBRXRGKCNH2
SCHEMBL1361008 0.84 PTGS1 (0.34) PTGS1EPHX2PTGS2RXRARXRB
SCHEMBL1360271 0.83 RXRA (0.38) PTGS1EPHX2PTGS2RXRARXRB
SCHEMBL7460783 0.81 MAPKAPK2 (0.35) ADH5RXRARXRBRXRGKCNH2
SCHEMBL1362191 0.81 KDM4E (0.38) TLR8KCNH2
SCHEMBL1363280 0.81 NAMPT (0.37) GRM2MAPK1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067453-B2 Oxazole compound to treat or prevent diabetic neuropathy; 4-(4-chlorophenyl)-5-(3-(2-methoxyphenoxy)propyl-2-methyl-1-imidazolyl)oxazole TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-11-29 US disclosed
US-20080269219-A1 Neurotrophin production/secretion promoting agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-10-30 US disclosed
US-7396848-B1 oxazole derivatives to treat diabetic neuropathy and/or other kinds of peripheral neuropathy; 4-(4-chlorophenyl)-5-[3-(2-methoxyphenoxy)propyl]-2-(2-methyl-1-imidazolyl)oxazole TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-08 US disclosed
US-6699995-B1 ALKYLATION AT 5-POSITION OF OXAZOLE BY REACTION WITH UNSATURATED COMPOUND IN PRESENCE OF ACID OR BASE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2004-03-02 US disclosed
EP-1219610-B1 PROCESS FOR THE PREPARATION OF OXAZOLE DERIVATIVES TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-02-25 EP disclosed
EP-1206472-B1 OXAZOLE AND THIAZOLE DERIVATIVES AS NEUROTROPHIN PRODUCTION/SECRETION PROMOTING AGENT TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-10-01 EP disclosed
US-6605629-B1 Oxazole derivatives; low toxicity TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2003-08-12 US disclosed
EP-1219610-A1 PROCESS FOR THE PREPARATION OF OXAZOLE DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080269219-A1 Neurotrophin production/secretion promoting agent BDNF, NGF, NTRK2 PTGS1 967/4885EPHX2 2376/4885PTGS2 1530/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.