SCHEMBL2096178

SCHEMBL2096178

Cc1cc(C)c([CH]c2c(F)c(F)c(F)c(F)c2F)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 5/20 0.36
FFAR4 Q5NUL3 1/20 0.32
HPGD P15428 1/20 0.32
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA12 O43570 1/20 0.31
CA7 P43166 1/20 0.31
CA13 Q8N1Q1 1/20 0.31
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
MMP13 P45452 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
SCHEMBL2093323 0.84 RAPGEF4 (0.43) RAPGEF4FFAR4HPGDCA1CA2
SCHEMBL5672536 0.72 VCP (0.35) CA1CA2CA12CA7CA13
SCHEMBL7025202 0.70 RAPGEF4 (0.46) RAPGEF4FFAR4
SCHEMBL662008 0.70 RAPGEF4 (0.46) RAPGEF4FFAR4
SCHEMBL699401 0.68 RAPGEF4 (0.43) RAPGEF4FFAR4HPGDCA1CA2
SCHEMBL699400 0.68 RAPGEF4 (0.43) RAPGEF4FFAR4HPGDCA1CA2
SCHEMBL4140090 0.67 RAPGEF4 (0.40) RAPGEF4FFAR4CA1CA2CA12
Ammonia Solution, Strong SCHEMBL1984066 0.66 RAPGEF4 (0.41) RAPGEF4FFAR4HPGDCA1CA2
SCHEMBL1612945 0.66 RAPGEF4 (0.41) RAPGEF4FFAR4HPGDCA1CA2
SCHEMBL23255961 0.65 RAPGEF4 (0.36) RAPGEF4FFAR4HPGDCA1CA2

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 RAPGEF4 4155/4885FFAR4 141/4885HPGD 1951/4885

“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.