SCHEMBL5540970

SCHEMBL5540970

C[C@](O)(COC(=O)Nc1ccc(F)cc1)Cn1cc([N+](=O)[O-])nc1Cl

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
SOS1 Q07889 1/20 0.42
KMT2A Q03164 4/20 0.40
AR P10275 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 4/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ALPL P05186 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL5540972 1.00 GAA (0.43) GAAMAPTSOS1KMT2AAR
SCHEMBL5544944 0.92 KMT2A (0.43) GAAMAPTKMT2ASMN1; SMN2MEN1
SCHEMBL5544939 0.92 KMT2A (0.43) GAAMAPTKMT2ASMN1; SMN2MEN1
SCHEMBL5545551 0.91 KMT2A (0.39) MAPTKMT2AARMEN1ALDH1A1
SCHEMBL5545547 0.91 KMT2A (0.39) MAPTKMT2AARMEN1ALDH1A1
SCHEMBL5541500 0.91 KMT2A (0.40) MAPTKMT2AMEN1ALDH1A1NPC1
SCHEMBL5541509 0.91 KMT2A (0.40) MAPTKMT2AMEN1ALDH1A1NPC1
SCHEMBL5534917 0.89 KMT2A (0.41) MAPTKMT2AARSMN1; SMN2MEN1
SCHEMBL5534918 0.89 KMT2A (0.41) MAPTKMT2AARSMN1; SMN2MEN1
SCHEMBL5544128 0.85 MAPT (0.46) MAPTKMT2ASMN1; SMN2MEN1ALDH1A1

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
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-05-04 US disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP 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-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 GAA 4165/4885MAPT 4117/4885SOS1 768/4885

“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.