SCHEMBL2092895

SCHEMBL2092895

Cc1ccc(C=CC[C]=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 3/20 0.43
CYP2A6 P11509 1/20 0.43
FBP1 P09467 1/20 0.42
MAPT P10636 3/20 0.41
RAB9A P51151 4/20 0.41
NPC1 O15118 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RELA Q04206 1/20 0.41
CA1 P00915 1/20 0.41
KMT2A Q03164 1/20 0.41
GRIK1 P39086 1/20 0.41
GRIK2 Q13002 1/20 0.41
CYP3A4 P08684 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
FOS P01100 1/20 0.39
JUN P05412 1/20 0.39
ALOX5 P09917 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38

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
SCHEMBL2092894 1.00 NFE2L2 (0.43) NFE2L2CYP2A6FBP1MAPTRAB9A
SCHEMBL6882721 0.81 NFE2L2 (0.45) NFE2L2CYP2A6FBP1MAPTRAB9A
SCHEMBL6882718 0.81 NFE2L2 (0.45) NFE2L2CYP2A6FBP1MAPTRAB9A
SCHEMBL2092456 0.79 HSD11B1 (0.45) NFE2L2FBP1GRIK1GRIK2PTGS1
SCHEMBL9161050 0.79 MAOB (0.48) NFE2L2FBP1MAPTRAB9ANPC1
SCHEMBL29080283 0.79 RAB9A (0.49) NFE2L2CYP2A6FBP1MAPTRAB9A
SCHEMBL2090683 0.79 CYP1A2 (0.45) FBP1MAPTGRIK1GRIK2ALDH1A1
SCHEMBL2090681 0.79 CYP1A2 (0.45) FBP1MAPTGRIK1GRIK2ALDH1A1
SCHEMBL97506 0.79 GRIK1 (0.41) MAPTRAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL2092453 0.79 HSD11B1 (0.45) NFE2L2FBP1GRIK1GRIK2PTGS1

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-8163753-B2 2-(4-(4-(4-chlorophenyl)oxazol-2-yl)phenoxymethyl)-2-methyl-6-nitro-2,3-dihydroimidazo[2,1-b]oxazole; bactericide; excellent bactericidal action against Mycobacterium tuberculosis, multi-drug-resistant Mycobacterium tuberculosis, and atypical acid-fast bacteria OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-04-24 US disclosed
EP-1678185-B1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMA CO LTD (JP) 2008-10-08 EP disclosed
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis OTSUKA PHAMACEUTICAL CO., LTD. (JP) 2008-05-22 US disclosed
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 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-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis NR2C2, NR0B2, NR4A2 NFE2L2 418/4885CYP2A6 1153/4885FBP1 784/4885

“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.