SCHEMBL2097739

SCHEMBL2097739

O=C(Nc1ccc(C(F)(F)F)cc1)N1CCC[N]CC1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.59
CNR1 P21554 1/20 0.58
CNR2 P34972 1/20 0.58
NAMPT P43490 1/20 0.56
TRPV1 Q8NER1 9/20 0.55
KDM4E B2RXH2 1/20 0.53
PKM P14618 1/20 0.53
HPGDS O60760 1/20 0.52
KMT2A Q03164 1/20 0.51
EPHX2 P34913 1/20 0.51
FAAH O00519 1/20 0.51
PRKAB2 O43741 1/20 0.51
PRKAG1 P54619 1/20 0.51
PRKAA2 P54646 1/20 0.51
PRKAA1 Q13131 1/20 0.51
PRKAG3 Q9UGI9 1/20 0.51
PRKAG2 Q9UGJ0 1/20 0.51
PRKAB1 Q9Y478 1/20 0.51

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
SCHEMBL4559682 0.87 MAPT (0.73) MAPTCNR1CNR2NAMPTTRPV1
SCHEMBL14306236 0.87 MAPT (0.69) MAPTCNR1CNR2NAMPTTRPV1
SCHEMBL6153200 0.86 KMT2A (0.69) MAPTCNR1CNR2NAMPTTRPV1
SCHEMBL2093466 0.83 EPHX2 (0.76) NAMPTTRPV1EPHX2
SCHEMBL2089614 0.82 LMNA (0.56) MAPTCNR1CNR2TRPV1KMT2A
SCHEMBL2091799 0.82 RAB9A (0.72) KDM4EKMT2AFAAH
SCHEMBL2093395 0.82 RAB9A (0.51) MAPTKDM4EKMT2AEPHX2FAAH
SCHEMBL2096525 0.82 RAB9A (0.72) MAPTNAMPTKDM4EKMT2A
SCHEMBL2091476 0.79 HPGD (0.72) CNR1CNR2KMT2AEPHX2
SCHEMBL2094189 0.78 SMN1; SMN2 (0.74) MAPTKMT2A

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 MAPT 4299/4885CNR1 197/4885CNR2 327/4885

“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.