SCHEMBL2094597

SCHEMBL2094597

Cc1cccc(/C=C/C[O])c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.53
PTGS1 P23219 3/20 0.50
PTGS2 P35354 3/20 0.50
ALOX5 P09917 1/20 0.50
TP53 P04637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
RELA Q04206 2/20 0.49
NPC1 O15118 2/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
MAOA P21397 3/20 0.45
MAOB P27338 3/20 0.45
ACHE P22303 1/20 0.42
NR1H3 Q13133 1/20 0.42
PPARG P37231 1/20 0.41
IDO1 P14902 2/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL2094600 1.00 FBP1 (0.53) FBP1PTGS1PTGS2ALOX5TP53
SCHEMBL2092978 0.82 FBP1 (0.51) FBP1PTGS1PTGS2ALOX5TP53
SCHEMBL25884157 0.82 FBP1 (0.51) FBP1PTGS1PTGS2ALOX5TP53
SCHEMBL8442069 0.82 TP53 (0.52) FBP1PTGS1PTGS2ALOX5TP53
SCHEMBL19227545 0.82 TP53 (0.52) FBP1PTGS1PTGS2ALOX5TP53
SCHEMBL8442071 0.82 TP53 (0.52) FBP1PTGS1PTGS2ALOX5TP53
SCHEMBL1795132 0.80 PTGS1 (0.69) FBP1PTGS1PTGS2ALOX5TP53
SCHEMBL21847980 0.80 PTGS1 (0.69) FBP1PTGS1PTGS2ALOX5TP53
SCHEMBL1795130 0.80 PTGS1 (0.69) FBP1PTGS1PTGS2ALOX5TP53
SCHEMBL5045793 0.80 PTGS1 (0.50) FBP1PTGS1PTGS2ALOX5TP53

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 FBP1 784/4885PTGS1 2872/4885PTGS2 1591/4885

“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.