SCHEMBL2091070

SCHEMBL2091070

[CH2]OCC=Cc1ccc(OC)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.53
CYP3A4 P08684 2/20 0.53
LMNA P02545 2/20 0.53
TP53 P04637 1/20 0.53
TSHR P16473 1/20 0.53
ALDH1A1 P00352 1/20 0.53
TRPA1 O75762 1/20 0.52
RELA Q04206 1/20 0.52
CYP1A2 P05177 3/20 0.50
CYP1A1 P04798 3/20 0.50
CYP1B1 Q16678 3/20 0.50
ESR1 P03372 2/20 0.50
PTGS2 P35354 2/20 0.50
AHR P35869 2/20 0.50
ABL1 P00519 1/20 0.50
TTR P02766 1/20 0.50
ABCB1 P08183 1/20 0.50
ALOX5 P09917 1/20 0.50
BCR P11274 1/20 0.50
CYP19A1 P11511 1/20 0.50

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
SCHEMBL2091068 1.00 KDM4E (0.53) KDM4ECYP3A4LMNATP53TSHR
SCHEMBL11735863 0.84 KDM4E (0.57) KDM4ECYP3A4LMNATP53TSHR
SCHEMBL6545108 0.84 KDM4E (0.57) KDM4ECYP3A4LMNATP53TSHR
SCHEMBL17710969 0.84 KDM4E (0.57) KDM4ECYP3A4LMNATP53TSHR
SCHEMBL17710972 0.84 KDM4E (0.57) KDM4ECYP3A4LMNATP53TSHR
SCHEMBL6002518 0.81 KDM4E (0.50) KDM4ECYP3A4LMNATP53TSHR
SCHEMBL2089055 0.81 CYP1A1 (0.59) KDM4ECYP1A2CYP1A1CYP1B1ESR1
SCHEMBL2089058 0.81 CYP1A1 (0.59) KDM4ECYP1A2CYP1A1CYP1B1ESR1
SCHEMBL9061627 0.80 CYP3A4 (0.48) KDM4ECYP3A4LMNATP53TSHR
SCHEMBL6272130 0.80 KDM4E (0.57) KDM4ECYP3A4LMNATP53TSHR

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 KDM4E 4578/4885CYP3A4 1734/4885LMNA 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.