SCHEMBL2094896

SCHEMBL2094896

[O]Cc1cc2c(Cl)c(Cl)ccc2s1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 2/20 0.37
KDM4E B2RXH2 1/20 0.35
LOXL2 Q9Y4K0 1/20 0.34
CDC7 O00311 2/20 0.34
PLK4 O00444 2/20 0.34
DYRK3 O43781 2/20 0.34
ROCK2 O75116 2/20 0.34
PRKD3 O94806 2/20 0.34
MAP4K4 O95819 2/20 0.34
INSR P06213 2/20 0.34
CDK1 P06493 2/20 0.34
ROS1 P08922 2/20 0.34
PIM1 P11309 2/20 0.34
FGFR1 P11362 2/20 0.34
PRKACA P17612 2/20 0.34
RPS6KB1 P23443 2/20 0.34
CDK2 P24941 2/20 0.34
FLT4 P35916 2/20 0.34
KDR P35968 2/20 0.34
FLT3 P36888 2/20 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
SCHEMBL2092383 0.77 AGXT (0.33) SLC22A12KDM4ELOXL2AHR
SCHEMBL2089632 0.70 SLC9A1 (0.45) SLC22A12LOXL2HDAC1HDAC8HDAC6
SCHEMBL6338729 0.69 CCNC (0.48) CDC7PLK4DYRK3ROCK2PRKD3
SCHEMBL15697576 0.69 HDAC3 (0.49) KDM4EPLK4CDK1PIM1PRKACA
SCHEMBL2094705 0.68 AKR1B1 (0.41) KDM4ELOXL2ALOX5HDAC6AKR1B1
SCHEMBL18263990 0.66 ALDH1A1 (0.45) KDM4EJAK2HDAC1HDAC8HDAC6
SCHEMBL6331785 0.66 CCNC (0.49) KDM4ERPS6KB1KDRCSNK1DGSK3B
SCHEMBL158372 0.64 KDM4E (0.56) KDM4ELOXL2CD274HDAC1HDAC8
SCHEMBL2451527 0.64 CYP2A6 (0.64) LOXL2HDAC1HDAC8HDAC6HDAC3
SCHEMBL9209273 0.64 HDAC3 (0.47) SLC22A12KDM4ELOXL2ALOX5HDAC1

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 SLC22A12 2107/4885KDM4E 4578/4885LOXL2 3512/4885

“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.