SCHEMBL1361085

SCHEMBL1361085

Nc1nc(-c2ccc(Cl)cc2)c(CCCCO)s1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.68
ALDH1A1 P00352 6/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
GAA P10253 2/20 0.50
MYC P01106 1/20 0.45
WDR5 P61964 1/20 0.45
CYP1A2 P05177 2/20 0.43
MAPT P10636 3/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
PTGDR2 Q9Y5Y4 5/20 0.41
COPS5 Q92905 1/20 0.40
SIRT2 Q8IXJ6 1/20 0.40
KDM4E B2RXH2 3/20 0.39
HPGD P15428 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
LMNA P02545 1/20 0.39
GBA1 P04062 1/20 0.39

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
SCHEMBL10358535 0.90 HTT (0.73) HTTALDH1A1SMN1; SMN2GAAMYC
Carbamic Acid SCHEMBL10358650 0.83 HTT (0.64) HTTALDH1A1SMN1; SMN2GAAMYC
SCHEMBL1363296 0.81 HTT (0.49) HTTALDH1A1SMN1; SMN2GAACYP1A2
SCHEMBL5209901 0.79 HTT (0.66) HTTALDH1A1SMN1; SMN2GAACYP1A2
SCHEMBL10358692 0.77 HTT (0.56) HTTALDH1A1SMN1; SMN2GAACYP1A2
SCHEMBL27995931 0.77 HTT (0.77) HTTALDH1A1SMN1; SMN2GAAMYC
SCHEMBL1361173 0.76 HTT (0.62) HTTALDH1A1SMN1; SMN2GAACYP1A2
SCHEMBL10358652 0.76 HTT (0.61) HTTALDH1A1SMN1; SMN2GAAMYC
SCHEMBL9089208 0.76 HTT (0.68) HTTALDH1A1SMN1; SMN2GAAMYC
SCHEMBL1361654 0.76 HTT (0.42) HTTALDH1A1CYP1A2PTGDR2SIRT2

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 9 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
CN-1291985-C Neurotrophin production/secretion promoting agent TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2006-12-27 CN 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
CN-1372557-A Neurotrophin production/secretion promoting agent TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2002-10-02 CN disclosed
EP-1206472-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS NEUROTROPHIN PRODUCTION/SECRETION PROMOTING AGENT Takeda Chemical Industries, Ltd. (JP) 2002-05-22 EP disclosed
WO-2001014372-A2 OXAZOLE AND THIAZOLE DERIVATIVES AS NEUROTROPHIN PRODUCTION/SECRETION PROMOTING AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-01 WO 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 HTT 1226/4885ALDH1A1 937/4885SMN1; SMN2 88/4885

“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.