SCHEMBL5542835

SCHEMBL5542835

CCC1Oc2ccccc2C1[O]

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 4/20 0.41
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.33
PKM P14618 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
ATM Q13315 1/20 0.32
POLB P06746 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
SCHEMBL12236947 0.78 ABCB1 (0.41) ABCB1KMT2AMEN1USP2TSHR
SCHEMBL13062858 0.78 ABCB1 (0.57) ABCB1KMT2AMEN1USP2TSHR
SCHEMBL5542843 0.77 MAOA (0.41) ABCB1KMT2AMEN1USP2TSHR
SCHEMBL13551756 0.77 ABCB1 (0.41) ABCB1KMT2AMEN1USP2TSHR
SCHEMBL8427998 0.75 KMT2A (0.41) ABCB1KMT2AMEN1USP2TSHR
SCHEMBL7422948 0.75 KMT2A (0.41) ABCB1KMT2AMEN1USP2TSHR
SCHEMBL14297504 0.74 ABCB1 (0.39) ABCB1KMT2AMEN1USP2TSHR
SCHEMBL5546128 0.74 ABCB1 (0.37) ABCB1KMT2AMEN1USP2MAOA
SCHEMBL13511910 0.73 ABCB1 (0.38) ABCB1KMT2AMEN1USP2TSHR
SCHEMBL8787996 0.73 KMT2A (0.39) ABCB1KMT2AMEN1USP2TSHR

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
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

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 ABCB1 2408/4885KMT2A 4267/4885MEN1 3295/4885

“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.