SCHEMBL2095036

SCHEMBL2095036

[CH2]OCc1csc2ccc(Cl)cc12

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 5/20 0.63
KEAP1 Q14145 1/20 0.56
NFE2L2 Q16236 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.55
CA2 P00918 1/20 0.51
MAPT P10636 1/20 0.45
FFAR4 Q5NUL3 1/20 0.45
PKM P14618 1/20 0.41
EPHX1 P07099 1/20 0.41
UTS2R Q9UKP6 2/20 0.40
EGFR P00533 1/20 0.40
ERBB2 P04626 1/20 0.40
EPHA2 P29317 1/20 0.40
KDR P35968 1/20 0.40
EPHB4 P54760 1/20 0.40
GAB1 Q13480 1/20 0.40

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
SCHEMBL1520550 0.83 CYP2A6 (0.68) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL2089678 0.81 CYP2A6 (0.69) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL2095364 0.80 CA2 (0.51) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL6003431 0.80 CYP2A6 (0.58) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL5541315 0.80 CYP2A6 (0.58) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL4418009 0.79 CYP2A6 (0.71) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL5543498 0.78 CYP2A6 (0.65) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL2094708 0.77 CYP2A6 (0.69) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL2949120 0.77 CYP2A6 (0.69) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2
SCHEMBL156931 0.77 CYP2A6 (0.69) CYP2A6KEAP1NFE2L2SMN1; SMN2CA2

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 CYP2A6 1153/4885KEAP1 2214/4885NFE2L2 418/4885

“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.