SCHEMBL2092945

SCHEMBL2092945

CC(=O)N1CCC(Oc2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.61
EPHX2 P34913 4/20 0.58
TEAD1 P28347 1/20 0.54
ADRB2 P07550 1/20 0.54
MMP13 P45452 5/20 0.50
MMP2 P08253 4/20 0.50
LIPG Q9Y5X9 2/20 0.49
LIPC P11150 1/20 0.49
FPR2 P25090 1/20 0.49
PROKR1 Q8TCW9 1/20 0.49
CYP4F2 P78329 1/20 0.48
CYP4A11 Q02928 1/20 0.48
NAMPT P43490 1/20 0.47
MMP12 P39900 1/20 0.47
CHEK2 O96017 1/20 0.46

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
SCHEMBL16217333 0.87 CYP4F2 (0.49) LIPEEPHX2CYP4F2CYP4A11NAMPT
SCHEMBL23365220 0.87 EPHX2 (0.62) LIPEEPHX2TEAD1ADRB2MMP13
SCHEMBL2089684 0.86 EPHX2 (0.60) LIPEEPHX2MMP13MMP2FPR2
SCHEMBL5545281 0.86 EPHX2 (0.61) LIPEEPHX2TEAD1ADRB2MMP13
SCHEMBL3222147 0.86 EPHX2 (0.58) LIPEEPHX2TEAD1ADRB2MMP13
SCHEMBL2092942 0.86 EPHX2 (0.58) LIPEEPHX2TEAD1ADRB2MMP13
SCHEMBL14413624 0.85 EPHX2 (0.64) LIPEEPHX2TEAD1ADRB2MMP13
SCHEMBL5538341 0.84 GPR119 (0.63) LIPEEPHX2TEAD1ADRB2MMP13
SCHEMBL13873132 0.83 EPHX2 (0.61) LIPEEPHX2TEAD1ADRB2MMP13
SCHEMBL11001792 0.82 LIPE (0.67) LIPEEPHX2TEAD1ADRB2MMP13

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 LIPE 4738/4885EPHX2 3472/4885TEAD1 2436/4885

“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.