SCHEMBL5540674

SCHEMBL5540674

CC#C[CH]c1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.44
CYP2A6 P11509 2/20 0.44
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ACHE P22303 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
GRIN2D O15399 2/20 0.38
GRIN3B O60391 2/20 0.38
GRIN1 Q05586 2/20 0.38
GRIN2A Q12879 2/20 0.38
GRIN2B Q13224 2/20 0.38
GRIN2C Q14957 2/20 0.38
GRIN3A Q8TCU5 2/20 0.38
ALDH1A1 P00352 2/20 0.38
RELA Q04206 1/20 0.37
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
RECQL P46063 1/20 0.37

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
SCHEMBL2658166 0.77 ALDH1A1 (0.38) NFE2L2CYP2A6TDP1ALDH1A1RELA
SCHEMBL9512577 0.72 ALDH1A1 (0.46) NFE2L2CYP2A6RAB9ANPC1SMN1; SMN2
SCHEMBL3230155 0.72 CYP2A6 (0.46) NFE2L2CYP2A6RAB9ANPC1SMN1; SMN2
SCHEMBL10892985 0.69 CYP2A6 (0.48) NFE2L2CYP2A6RAB9ANPC1SMN1; SMN2
(E)-1,2-Di-P-Tolylethene SCHEMBL1305580 0.66 NFE2L2 (0.74) NFE2L2CYP2A6RAB9ANPC1SMN1; SMN2
SCHEMBL318786 0.66 NFE2L2 (0.74) NFE2L2CYP2A6RAB9ANPC1SMN1; SMN2
(E)-1,2-Di-P-Tolylethene SCHEMBL1305582 0.66 NFE2L2 (0.74) NFE2L2CYP2A6RAB9ANPC1SMN1; SMN2
(E)-1,2-Di-P-Tolylethene SCHEMBL1793692 0.66 NFE2L2 (0.74) NFE2L2CYP2A6RAB9ANPC1SMN1; SMN2
SCHEMBL1149391 0.66 CYP2A6 (0.58) NFE2L2CYP2A6RAB9ANPC1SMN1; SMN2
SCHEMBL318785 0.66 NFE2L2 (0.74) NFE2L2CYP2A6RAB9ANPC1SMN1; 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
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 NFE2L2 846/4885CYP2A6 1119/4885RAB9A 2824/4885

“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.