SCHEMBL5544208

SCHEMBL5544208

[CH2]c1scc2cccc(OC(F)(F)F)c12

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MPL P40238 1/20 0.41
SCN9A Q15858 9/20 0.37
CYP2C9 P11712 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
SLC40A1 Q9NP59 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GRM5 P41594 1/20 0.30

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
SCHEMBL5544215 0.80 SCN9A (0.46) MPLSCN9ACYP2C9CYP3A4CYP2D6
SCHEMBL5542280 0.77 KDM4E (0.39) CYP3A4KDM4E
SCHEMBL5534900 0.76 MPL (0.40) MPLSCN9ACYP2C9CYP3A4CYP2D6
SCHEMBL5546627 0.73 MPL (0.38) MPLSCN9ACYP2C9CYP3A4CYP2D6
SCHEMBL2093124 0.71 KDM4E (0.32) MPLKDM4E
SCHEMBL1044967 0.69 KDM4E (0.39) MPLSCN9AKDM4E
SCHEMBL23043355 0.68 MPL (0.36) MPLSCN9ACYP3A4SLC40A1KDM4E
SCHEMBL4078653 0.68 MPL (0.42) MPLSCN9ACYP3A4SLC40A1KDM4E
SCHEMBL23465150 0.68 S1PR1 (0.39) MPLSCN9ACYP3A4SLC40A1KDM4E
SCHEMBL5535970 0.68 CHRNA7 (0.41) MPLSCN9ACYP2C9CYP3A4CYP2D6

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 MPL 4578/4885SCN9A 3612/4885CYP2C9 2351/4885

“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.