SCHEMBL2092932

SCHEMBL2092932

[CH2]c1ncsc1-c1ccccc1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPL P40238 1/20 0.40
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 2/20 0.37
ADORA2A P29274 2/20 0.37
MAPK14 Q16539 1/20 0.36
NPC1 O15118 3/20 0.36
NOTUM Q6P988 1/20 0.33
IDO1 P14902 1/20 0.33
GSTO1 P78417 1/20 0.33
GAA P10253 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
ADORA1 P30542 1/20 0.33
MAPT P10636 1/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
EGLN2 Q96KS0 1/20 0.33

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
SCHEMBL5544663 0.79 KMO (0.36) ADORA2ANPC1GAARAB9AADORA1
SCHEMBL2093838 0.78 CYP19A1 (0.38) ALDH1A1KDM4ENPC1NOTUMIDO1
SCHEMBL13616805 0.78 MPL (0.47) MPLALDH1A1KDM4EADORA2AMAPK14
SCHEMBL2092935 0.78 MPL (0.40) MPLALDH1A1KDM4EMAPK14NPC1
SCHEMBL2095688 0.74 MAPK14 (0.42) MPLALDH1A1KDM4EADORA2AMAPK14
SCHEMBL2097336 0.72 KDM4E (0.53) ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL983271 0.68 KDM4E (0.42) ALDH1A1KDM4ENPC1GAARAB9A
SCHEMBL2096848 0.68 HCRTR1 (0.40) MPLALDH1A1KDM4ENPC1GAA
SCHEMBL2095690 0.67 MBNL1 (0.44) MPLALDH1A1KDM4EADORA2AMAPK14
SCHEMBL5536790 0.65 MPL (0.50) MPLALDH1A1KDM4ENPC1GSTO1

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
CN-100497345-C 2, 3-dihydro-6-nitroimidazolo [2,1-b] oxazole compounds for the treatment of tuberculosis OTSUKA PHARMA CO LTD (JP) 2009-06-10 CN 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
CN-1878777-A 2,3-dihydro-6-nitroimidazo (2,1-b) oxazole compounds for the treatment of tuberculosis OTSUKA PHARMA CO LTD (JP) 2006-12-13 CN 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 MPL 3349/4885ALDH1A1 412/4885KDM4E 4578/4885

“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.