SCHEMBL515174

SCHEMBL515174

[CH2]OC(=O)Nc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.69
MAPT P10636 3/20 0.59
TRPV1 Q8NER1 3/20 0.56
KMT2A Q03164 1/20 0.56
FAAH O00519 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.53
KDM4E B2RXH2 2/20 0.53
HPGD P15428 1/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
EPHX1 P07099 2/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
GAA P10253 1/20 0.49

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
SCHEMBL2094665 0.87 EPHX2 (0.51) EPHX2MAPTTRPV1KMT2AFAAH
SCHEMBL515175 0.84 EPHX2 (0.71) EPHX2MAPTTRPV1KMT2AFAAH
SCHEMBL2092782 0.83 EPHX2 (0.46) EPHX2MAPTTRPV1KMT2AL3MBTL1
SCHEMBL2098157 0.82 EPHX2 (0.63) EPHX2MAPTTRPV1KMT2AFAAH
SCHEMBL11555827 0.82 EPHX2 (1.00) EPHX2MAPTTRPV1KMT2AFAAH
SCHEMBL2094765 0.81 ALDH1A1 (0.56) EPHX2MAPTHPGDNPC1RAB9A
SCHEMBL2096312 0.80 EPHX2 (0.76) EPHX2MAPTTRPV1KMT2AFAAH
SCHEMBL2096310 0.80 EPHX2 (0.76) EPHX2MAPTTRPV1KMT2AFAAH
SCHEMBL3427239 0.80 EPHX2 (0.65) EPHX2MAPTTRPV1KMT2AFAAH
SCHEMBL8471523 0.80 EPHX2 (0.65) EPHX2MAPTTRPV1KMT2AFAAH

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014184070-A1 MIXTURES OF HALOALKYLSULFONANILIDE DERIVATIVES AND HERBICIDES SYNGENTA LIMITED (GB) 2014-11-20 WO disclosed
WO-2014184071-A1 MIXTURES OF HALOALKYLSULFONANILIDE DERIVATIVES AND HERBICIDES SYNGENTA LIMITED (GB) 2014-11-20 WO disclosed
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-2420493-A1 HALOALKYLSULFONANILIDE DERIVATIVE Nissan Chemical Industries, Ltd. (JP) 2012-02-22 EP disclosed
US-20120029187-A1 HALOALKYLSULFONANILIDE DERIVATIVE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-02-02 US disclosed
EP-2336104-A1 ORTHO-SUBSTITUTED HALOALKYLSULFONANILIDE DERIVATIVE AND HERBICIDE Nissan Chemical Industries, Ltd. (JP) 2011-06-22 EP 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 (2 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 EPHX2 3472/4885MAPT 4299/4885TRPV1 2567/4885
US-20120029187-A1 HALOALKYLSULFONANILIDE DERIVATIVE CBR3, CBR1, HDHD5 EPHX2 1753/4885MAPT 4824/4885TRPV1 3056/4885

“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.