SCHEMBL2090294

SCHEMBL2090294

[CH2]OCc1nnnn1-c1ccc(Cl)cc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.65
PKM P14618 2/20 0.53
HTT P42858 1/20 0.53
NLRP3 Q96P20 1/20 0.53
CYP1A2 P05177 1/20 0.52
CYP2C19 P33261 1/20 0.52
LMNA P02545 4/20 0.49
KMT2A Q03164 1/20 0.48
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MAPT P10636 1/20 0.47
HSD17B10 Q99714 1/20 0.46
GAA P10253 1/20 0.45
IDO1 P14902 1/20 0.45
PTGS2 P35354 2/20 0.40

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
SCHEMBL2095298 0.85 HTT (0.71) ALDH1A1PKMHTTNLRP3LMNA
SCHEMBL6002885 0.84 CYP1A2 (0.53) ALDH1A1PKMHTTNLRP3CYP1A2
SCHEMBL2090296 0.84 ALDH1A1 (0.61) ALDH1A1PKMHTTNLRP3CYP1A2
SCHEMBL5546774 0.81 CYP1A2 (0.56) ALDH1A1PKMHTTNLRP3CYP1A2
SCHEMBL2090299 0.80 PKM (0.49) ALDH1A1PKMHTTNLRP3CYP1A2
SCHEMBL25250647 0.80 ALDH1A1 (0.72) ALDH1A1PKMHTTNLRP3CYP1A2
SCHEMBL14438050 0.78 ALDH1A1 (0.57) ALDH1A1CYP1A2CYP2C19LMNANPSR1
SCHEMBL25218290 0.78 CYP1A2 (0.60) ALDH1A1PKMHTTNLRP3CYP1A2
SCHEMBL2094441 0.78 PRMT1 (0.56) ALDH1A1PKMHTTNLRP3LMNA
SCHEMBL14438051 0.73 ALDH1A1 (0.52) ALDH1A1CYP1A2CYP2C19LMNANPSR1

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 ALDH1A1 412/4885PKM 3041/4885HTT 4689/4885

“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.