SCHEMBL2092771

SCHEMBL2092771

[CH2]OC(=O)Nc1ccccc1-c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 8/20 0.55
CHRM2 P08172 4/20 0.55
CHRM1 P11229 4/20 0.55
ALDH1A1 P00352 4/20 0.54
MEN1 O00255 1/20 0.54
CYP2C9 P11712 1/20 0.54
HPGD P15428 1/20 0.54
KMT2A Q03164 1/20 0.54
MAPT P10636 2/20 0.50
HTT P42858 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TSHR P16473 1/20 0.50
KDM4E B2RXH2 2/20 0.49
LMNA P02545 1/20 0.49
NPY1R P25929 1/20 0.49
NPY2R P49146 1/20 0.49
ATM Q13315 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
SCHEMBL2092774 0.84 ALDH1A1 (0.57) CHRM3CHRM2CHRM1ALDH1A1MEN1
SCHEMBL18762046 0.82 CHRM3 (0.55) CHRM3CHRM2CHRM1ALDH1A1MEN1
SCHEMBL28335754 0.81 MEN1 (0.60) CHRM3CHRM2CHRM1ALDH1A1MEN1
SCHEMBL622243 0.79 ALDH1A1 (0.59) ALDH1A1MEN1CYP2C9HPGDKMT2A
SCHEMBL17847512 0.79 CHRM3 (0.50) CHRM3CHRM2CHRM1ALDH1A1MEN1
SCHEMBL265014 0.79 ALDH1A1 (0.62) ALDH1A1MEN1CYP2C9HPGDKMT2A
SCHEMBL18415557 0.79 ALDH1A1 (0.62) ALDH1A1MEN1CYP2C9HPGDKMT2A
SCHEMBL34420050 0.79 CA12 (0.64) ALDH1A1MEN1CYP2C9HPGDKMT2A
SCHEMBL6514305 0.78 CHRM3 (0.52) CHRM3CHRM2CHRM1ALDH1A1MEN1
SCHEMBL28444082 0.78 CHRM3 (0.52) CHRM3CHRM2CHRM1ALDH1A1MEN1

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 CHRM3 1184/4885CHRM2 776/4885CHRM1 575/4885

“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.