SCHEMBL2093417

SCHEMBL2093417

FC(F)(F)Oc1ccccc1NC1CC[N]CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 1/20 0.50
▸ CRBN Q96SW2 1/20 0.50
▸ EPHX2 P34913 3/20 0.44
▸ GAA P10253 2/20 0.43
▸ C1R P00736 1/20 0.38
▸ IGF1R P08069 1/20 0.35
▸ P2RX7 Q99572 1/20 0.35
▸ GBA1 P04062 1/20 0.35
▸ CXCR2 P25025 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ EGFR P00533 2/20 0.34
▸ BTK Q06187 1/20 0.34
▸ SLC40A1 Q9NP59 1/20 0.34
▸ SCD O00767 1/20 0.34
▸ HCAR1 Q9BXC0 1/20 0.34
▸ SSTR1 P30872 1/20 0.34
▸ SSTR4 P31391 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2J2 P51589 1/20 0.34

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
SCHEMBL2091909 0.88 DDB1 (0.40) DDB1CRBNEPHX2GAAKDM4E
SCHEMBL2090904 0.80 RAB9A (0.49) GAAMAPT
SCHEMBL2090803 0.76 SCD (0.53) GAAKDM4EMAPTSCD
SCHEMBL2299199 0.76 PDE3B (0.41) DDB1CRBNEPHX2SCDCYP2C9
SCHEMBL2095041 0.74 SCD (0.42) GAAKDM4EMAPTSCD
SCHEMBL2094800 0.74 GAA (0.53) GAAGBA1KDM4EMAPT
SCHEMBL2089441 0.74 GALR2 (0.48) EPHX2
SCHEMBL5537491 0.73 ME3 (0.44) DDB1CRBNEPHX2GAAGBA1
SCHEMBL5537487 0.73 DDB1 (0.46) DDB1CRBNEPHX2GAAEGFR
SCHEMBL6886595 0.72 HTR3A (0.60) DDB1CRBNEPHX2SSTR1SSTR4

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 DDB1 971/4885CRBN 3418/4885EPHX2 3472/4885

“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.

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