SCHEMBL5539181

SCHEMBL5539181

Clc1[c]c2ccc(Cl)cc2c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.39
AHR P35869 6/20 0.36
TSHR P16473 5/20 0.34
CYP3A4 P08684 3/20 0.34
HSD17B10 Q99714 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
MAPK1 P28482 1/20 0.32
CYP2A6 P11509 1/20 0.31
IDO1 P14902 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
SCHEMBL10740801 0.84 TP53 (0.37) TP53AHRTSHRCYP3A4HSD17B10
SCHEMBL3071001 0.77 CYP2A6 (0.40) AHRTSHRHSD17B10ALDH1A1LMNA
SCHEMBL10745593 0.68 POLB (0.43) TP53CYP3A4HSD17B10ALDH1A1LMNA
SCHEMBL1450256 0.68 HSD17B10 (0.41) CYP3A4HSD17B10ALDH1A1LMNAHTT
SCHEMBL5142985 0.65 CYP2A6 (0.46) TP53AHRTSHRCYP3A4HSD17B10
SCHEMBL10741019 0.64 POLB (0.35) TP53AHRTSHRCYP3A4HSD17B10
SCHEMBL11030089 0.64 TP53 (0.43) TP53AHRTSHRCYP3A4HSD17B10
SCHEMBL1392807 0.64 TP53 (0.32) TP53AHR
SCHEMBL1392439 0.63 CYP2A6 (0.34) CYP2A6
SCHEMBL5863631 0.62 TP53 (0.55) TP53AHRTSHRCYP3A4HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-05-04 US disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP disclosed
US-4654363-A Synthetic analogs of mevinolin MERCK & CO., INC. (US) 1987-03-31 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-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 TP53 4494/4885AHR 1471/4885TSHR 319/4885

“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.