SCHEMBL2090850

SCHEMBL2090850

Cc1ccc(Cl)cc1-c1nc(C[O])cs1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SHMT1 P34896 13/20 0.44
SHMT2 P34897 8/20 0.43
GFER P55789 1/20 0.43
LMNA P02545 3/20 0.42
MAPT P10636 2/20 0.42
TP53 P04637 1/20 0.42
PTGER1 P34995 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
RXFP1 Q9HBX9 1/20 0.38
IDO1 P14902 1/20 0.38

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
SCHEMBL2091378 0.76 GFER (0.72) GFERLMNAMAPTTP53ALDH1A1
SCHEMBL2091665 0.72 GFER (0.49) GFERLMNAMAPTTP53L3MBTL1
SCHEMBL20255689 0.69 SHMT1 (0.55) SHMT1SHMT2GFERLMNAMAPT
SCHEMBL16526969 0.68 SHMT1 (0.48) SHMT1SHMT2GFERLMNAMAPT
SCHEMBL19679625 0.68 RAB9A (0.51) MAPTL3MBTL1ALDH1A1IDO1
SCHEMBL2092986 0.68 CYP1A1 (0.51) GFERLMNAMAPTTP53ALDH1A1
SCHEMBL20383160 0.68 CYP3A4 (0.56) LMNAMAPTTP53ALDH1A1IDO1
SCHEMBL14098693 0.67 MAPT (0.60) SHMT1SHMT2LMNAMAPTPTGER1
SCHEMBL27665924 0.67 IDO1 (0.41) MAPTALDH1A1IDO1
SCHEMBL4720637 0.67 SHMT1 (0.56) SHMT1SHMT2LMNAMAPTPTGER1

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 SHMT1 1901/4885SHMT2 986/4885GFER 700/4885

“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.