SCHEMBL2089682

SCHEMBL2089682

[CH2]C(=O)N1CCC(Oc2ccc(OC(F)(F)F)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 15/20 0.54
FAAH O00519 5/20 0.52
MMP2 P08253 1/20 0.50
MMP13 P45452 1/20 0.50
AADAC P22760 1/20 0.47
HSD11B1 P28845 1/20 0.47
FPR2 P25090 2/20 0.46
PROKR1 Q8TCW9 2/20 0.46
EPHX1 P07099 2/20 0.46
MGLL Q99685 1/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2J2 P51589 1/20 0.46
CYP2C19 P33261 1/20 0.45

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
SCHEMBL6097817 0.87 EPHX2 (0.56) EPHX2FAAHMMP2MMP13AADAC
SCHEMBL2089684 0.86 EPHX2 (0.60) EPHX2FAAHMMP2MMP13AADAC
SCHEMBL2092942 0.86 EPHX2 (0.58) EPHX2MMP2MMP13FPR2PROKR1
SCHEMBL2097258 0.85 EPHX2 (0.47) EPHX2FAAHMMP2MMP13CYP2C9
SCHEMBL17422616 0.82 EPHX2 (0.56) EPHX2FAAHMMP2MMP13AADAC
SCHEMBL3028128 0.81 POLB (0.56) EPHX2FAAHMMP2MMP13FPR2
SCHEMBL2951108 0.81 GPR119 (0.63) EPHX2FAAHMMP2MMP13
SCHEMBL2096829 0.81 EPHX2 (0.55) EPHX2CYP2C9CYP2J2
SCHEMBL2091336 0.80 EPHX2 (0.57) EPHX2CYP2C9CYP2J2
SCHEMBL24937773 0.80 EPHX2 (0.49) EPHX2FAAHMMP2MMP13AADAC

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 EPHX2 3472/4885FAAH 3448/4885MMP2 4383/4885

“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.