SCHEMBL2090804

SCHEMBL2090804

[O]c1ccc(N2CCC(Oc3ccc(Cl)cc3Cl)CC2)c2scnc12

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 8/20 0.42
PROKR1 Q8TCW9 8/20 0.42
SCN8A Q9UQD0 4/20 0.38
SCN1A P35498 3/20 0.38
MMP13 P45452 1/20 0.38
SCD O00767 1/20 0.36
HRH1 P35367 2/20 0.35
CCR3 P51677 2/20 0.35
GPR6 P46095 1/20 0.35
MALT1 Q9UDY8 1/20 0.35
NOTUM Q6P988 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
SCHEMBL2090806 0.89 FPR2 (0.40) FPR2PROKR1SCN8ASCN1AMMP13
SCHEMBL27666407 0.82 FPR2 (0.41) FPR2PROKR1SCN8ASCN1AMMP13
SCHEMBL2094877 0.80 SLC6A2 (0.39) FPR2PROKR1CCR3NOTUM
SCHEMBL2095188 0.79 ACACB (0.33) FPR2PROKR1
SCHEMBL2091406 0.78 ACACB (0.34) GPR6MALT1
SCHEMBL5061674 0.76 KDM4E (0.47)
SCHEMBL2094217 0.69 PDE3B (0.44) SCD
SCHEMBL2095821 0.69 FPR2 (0.37) FPR2PROKR1HRH1CCR3
SCHEMBL2097566 0.69 FPR2 (0.42) FPR2PROKR1MMP13SCD
SCHEMBL2093990 0.69 ADORA2A (0.35) MALT1

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 FPR2 68/4885PROKR1 1963/4885SCN8A 3854/4885

“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.