SCHEMBL1361780

SCHEMBL1361780

Cc1cc(C)n(-c2nc(-c3ccc(Cl)cc3)c(CCCOc3ccccc3C)o2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.41
MAPT P10636 4/20 0.40
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
ALDH1A1 P00352 1/20 0.37
SLC34A1 Q06495 2/20 0.35
HPGD P15428 1/20 0.35
FABP4 P15090 3/20 0.35
FABP3 P05413 1/20 0.35
CYP3A4 P08684 3/20 0.34
CYP2C9 P11712 3/20 0.34
CYP2C19 P33261 3/20 0.34
CYP1A2 P05177 2/20 0.34
CETP P11597 1/20 0.34
CEPT1 Q9Y6K0 1/20 0.34
KMT2A Q03164 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
NTSR1 P30989 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL1361774 0.81 TP53 (0.46) TP53MAPTALDH1A1CYP2C19CETP
SCHEMBL203742 0.80 TP53 (0.41) TP53MAPTALDH1A1CETPCEPT1
SCHEMBL1362824 0.79 MAPK1 (0.43) TP53MAPTALDH1A1HPGDCYP3A4
Hydrochloric Acid SCHEMBL1362475 0.79 TP53 (0.41) TP53MAPTALDH1A1CETPCEPT1
SCHEMBL1362135 0.79 TP53 (0.44) TP53MAPTALDH1A1KMT2ASMN1; SMN2
SCHEMBL1363270 0.78 TP53 (0.40) TP53MAPTNPC1RAB9AKMT2A
SCHEMBL1362923 0.77 MAPT (0.42) TP53MAPTALDH1A1KMT2ASMN1; SMN2
SCHEMBL1362791 0.77 TP53 (0.39) TP53MAPTALDH1A1CETPCEPT1
SCHEMBL1362546 0.77 MAPT (0.42) TP53MAPTALDH1A1KMT2ASMN1; SMN2
SCHEMBL1360022 0.77 MAPT (0.42) TP53MAPTALDH1A1KMT2ASMN1; SMN2

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-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
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

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 TP53 4289/4885MAPT 3908/4885NPC1 2670/4885

“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.