SCHEMBL2090923

SCHEMBL2090923

COc1ccc(NC(=O)N2CCC[N]CC2)cc1OC

nearest known ligand 0.78

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.78
SMN1; SMN2 Q16637 3/20 0.65
ATM Q13315 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
SHMT2 P34897 1/20 0.55
GAA P10253 1/20 0.54
MAPT P10636 3/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
KMT2A Q03164 1/20 0.54
HTT P42858 1/20 0.51
NAMPT P43490 1/20 0.51
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50

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
SCHEMBL2094189 0.83 SMN1; SMN2 (0.74) SMN1; SMN2GAAMAPTALDH1A1KMT2A
SCHEMBL2097729 0.81 RAB9A (0.74) L3MBTL1SMN1; SMN2GAAMAPTMEN1
SCHEMBL11503430 0.80 L3MBTL1 (0.79) L3MBTL1SMN1; SMN2ATMNPSR1MAPT
SCHEMBL11355367 0.80 POLB (0.59) L3MBTL1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL8663635 0.79 HTR1A (0.76)
SCHEMBL2096525 0.79 RAB9A (0.72) L3MBTL1SMN1; SMN2MAPTMEN1ALDH1A1
SCHEMBL2092666 0.79 L3MBTL1 (0.47) L3MBTL1SMN1; SMN2MAPTALDH1A1HTT
SCHEMBL2093395 0.76 RAB9A (0.51) SMN1; SMN2GAAMAPTMEN1ALDH1A1
SCHEMBL2089614 0.76 LMNA (0.56) SMN1; SMN2NPSR1GAAMAPTMEN1
SCHEMBL2091799 0.76 RAB9A (0.72) SMN1; SMN2GAAMEN1ALDH1A1KMT2A

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 L3MBTL1 2575/4885SMN1; SMN2 3787/4885ATM 4071/4885

“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.