SCHEMBL2092255

SCHEMBL2092255

Cc1ccc(CC2CCN(c3ccc4nccc(O)c4c3)CC2)cc1C

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.42
CDK1 P06493 1/20 0.41
HTR1A P08908 5/20 0.37
HTR1D P28221 5/20 0.37
HTR1B P28222 5/20 0.37
CCR3 P51677 1/20 0.36
ENPP2 Q13822 1/20 0.35
MAPK14 Q16539 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
PRKDC P78527 1/20 0.35
ALK Q9UM73 1/20 0.35
CCR8 P51685 1/20 0.35
KCNH2 Q12809 1/20 0.35
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34

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
SCHEMBL2092251 0.87 TP53 (0.42) TP53CDK1HTR1AHTR1DHTR1B
SCHEMBL2093006 0.85 PRKDC (0.51) HTR1APRKDC
SCHEMBL27644889 0.81 CHKA (0.49) TP53HTR1AHTR1DHTR1BCCR3
SCHEMBL2090966 0.79 CHRM4 (0.47) KCNH2
SCHEMBL2089363 0.76 HTR1A (0.39) CDK1HTR1ACCR3
SCHEMBL2093002 0.72 PRKDC (0.51) HTR1APRKDC
SCHEMBL2098329 0.72 TP53 (0.38) TP53CDK1HTR1AHTR1DHTR1B
SCHEMBL5016247 0.68 HTR1A (0.43) CDK1HTR1APRKDC
SCHEMBL2089310 0.67 PDE3B (0.53)
SCHEMBL2098336 0.66 ACVR1 (0.38) ENPP2ALK

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
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
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO 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 TP53 4732/4885CDK1 1478/4885HTR1A 3561/4885

“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.