SCHEMBL2097708

SCHEMBL2097708

[O]CCCCOc1cccc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.56
USP2 O75604 1/20 0.54
LMNA P02545 1/20 0.54
HTT P42858 1/20 0.54
KDM4E B2RXH2 3/20 0.52
MRGPRX4 Q96LA9 1/20 0.52
ALDH1A1 P00352 2/20 0.51
GAA P10253 1/20 0.51
KCNA3 P22001 2/20 0.50
KCNA5 P22460 2/20 0.50
NR4A2 P43354 1/20 0.49
MCL1 Q07820 1/20 0.48
MAOB P27338 1/20 0.48
AOC3 Q16853 1/20 0.48
FAAH O00519 1/20 0.47

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
SCHEMBL2091175 0.98 L3MBTL1 (0.55) L3MBTL1USP2LMNAHTTKDM4E
SCHEMBL2089594 0.95 L3MBTL1 (0.57) L3MBTL1USP2LMNAHTTKDM4E
SCHEMBL2091560 0.90 L3MBTL1 (0.59) L3MBTL1USP2LMNAHTTKDM4E
SCHEMBL7199882 0.85 L3MBTL1 (0.57) L3MBTL1USP2LMNAHTTKDM4E
SCHEMBL7199868 0.83 L3MBTL1 (0.56) L3MBTL1USP2LMNAHTTKDM4E
SCHEMBL8188767 0.83 L3MBTL1 (0.56) L3MBTL1USP2LMNAHTTKDM4E
SCHEMBL22221774 0.83 L3MBTL1 (0.64) L3MBTL1USP2LMNAHTTKDM4E
SCHEMBL2097709 0.83 L3MBTL1 (0.56) L3MBTL1USP2LMNAHTTKDM4E
SCHEMBL31096458 0.83 L3MBTL1 (0.59) L3MBTL1USP2LMNAHTTKDM4E
SCHEMBL9721587 0.83 L3MBTL1 (0.59) L3MBTL1USP2LMNAHTTKDM4E

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 3 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

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 L3MBTL1 2575/4885USP2 1756/4885LMNA 4594/4885

“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.