SCHEMBL2096020

SCHEMBL2096020

[O]Cc1cc2ccsc2cc1F

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.38
PTPRC P08575 1/20 0.35
PTPN6 P29350 1/20 0.35
PTPN11 Q06124 1/20 0.35
PTPN22 Q9Y2R2 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
CYP17A1 P05093 2/20 0.34
CTNNB1 P35222 2/20 0.34
WNT3A P56704 2/20 0.34
CA12 O43570 5/20 0.32
CA2 P00918 5/20 0.32
DYRK1A Q13627 1/20 0.32
ACLY P53396 1/20 0.30

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
SCHEMBL3815945 0.80 CTNNB1 (0.40) CYP2A6PTPRCPTPN6PTPN11PTPN22
SCHEMBL3807796 0.79 CYP2A6 (0.36) CYP2A6PTPRCPTPN6PTPN11PTPN22
SCHEMBL6734101 0.78 CA2 (0.34) CYP2A6PTPRCPTPN6PTPN11PTPN22
SCHEMBL31015952 0.78 CYP2A6 (0.42) CYP2A6PTPRCPTPN6PTPN11PTPN22
SCHEMBL17842734 0.78 CYP2A6 (0.42) CYP2A6PTPRCPTPN6PTPN11PTPN22
SCHEMBL3809930 0.75 LMNA (0.39) MRGPRX4CTNNB1WNT3A
SCHEMBL13437602 0.72 CYP2A6 (0.42) CYP2A6PTPRCPTPN6PTPN11PTPN22
SCHEMBL3810161 0.72 FFAR1 (0.39) PTPRCPTPN6PTPN11PTPN22MRGPRX4
SCHEMBL6742999 0.71 CYP2A6 (0.37) CYP2A6PTPRCPTPN6PTPN11PTPN22
SCHEMBL21931029 0.71 DYRK1A (0.42) CYP2A6PTPRCPTPN6PTPN11PTPN22

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 1153/4885PTPRC 1688/4885PTPN6 1165/4885

“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.