SCHEMBL2094328

SCHEMBL2094328

COc1ccc(OC2CCN(c3cc([O])cc4ncsc34)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
MAPT P10636 1/20 0.41
GPR6 P46095 1/20 0.38
FFAR1 O14842 3/20 0.37
FPR2 P25090 1/20 0.37
PROKR1 Q8TCW9 1/20 0.37
CHRM4 P08173 2/20 0.37
PDE3B Q13370 6/20 0.36
PDE3A Q14432 6/20 0.36
PDE10A Q9Y233 6/20 0.36
NEK2 P51955 1/20 0.36
PLK1 P53350 1/20 0.36
ACACB O00763 1/20 0.35

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
SCHEMBL27645157 0.74 CHRM4 (0.40) FPR2PROKR1CHRM4
SCHEMBL27665970 0.72 DRD2 (0.38) PDE3BPDE3APDE10A
SCHEMBL2091406 0.69 ACACB (0.34) MAPTGPR6PDE3BPDE3APDE10A
SCHEMBL2093719 0.68 LIPG (0.36) FFAR1FPR2PROKR1CHRM4PDE3B
SCHEMBL2093005 0.67 PDE3B (0.43) MAPTFFAR1FPR2PROKR1CHRM4
SCHEMBL2090111 0.66 PDE3B (0.46) SMN1; SMN2MAPTCHRM4PDE3BPDE3A
SCHEMBL2088504 0.66 FPR2 (0.38) MAPTFPR2PROKR1CHRM4ACACB
SCHEMBL2091415 0.65 ACACB (0.34) SMN1; SMN2MAPTGPR6PDE3BPDE3A
SCHEMBL27665985 0.65 PDE3B (0.50) PDE3BPDE3APDE10ANEK2PLK1
SCHEMBL2095821 0.64 FPR2 (0.37) MAPTFFAR1FPR2PROKR1ACACB

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 SMN1; SMN2 3787/4885MAPT 4299/4885GPR6 465/4885

“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.