SCHEMBL5534469

SCHEMBL5534469

CCCc1cc(O)cc2ncsc12

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.43
ESR2 Q92731 6/20 0.43
PTPN1 P18031 4/20 0.39
PTPN11 Q06124 3/20 0.39
SREBF2 Q12772 2/20 0.33
PTPN2 P17706 1/20 0.32
HMGCR P04035 1/20 0.32
ALOX5 P09917 4/20 0.31
PTGS2 P35354 4/20 0.31
CYP3A4 P08684 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 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
SCHEMBL5534465 0.80 TAS1R3 (0.30) TAS1R3TAS1R1
SCHEMBL3640901 0.73 CYP3A4 (0.37) ESR1ESR2CYP3A4
SCHEMBL12948356 0.73 PRKCI (0.43) PTPN1PTPN11PTPN2CYP3A4TAS1R3
SCHEMBL27610699 0.72
SCHEMBL27364173 0.69 ESR1 (0.38) ESR1ESR2
SCHEMBL1760574 0.67 PTPN1 (0.53) ESR1ESR2PTPN1PTPN11PTPN2
SCHEMBL28722613 0.67 PTPN1 (0.53) ESR1ESR2PTPN1PTPN11PTPN2
SCHEMBL2091442 0.67 GPR84 (0.40) ALOX5PTGS2
SCHEMBL16440203 0.67 LTA4H (0.42) CYP3A4
SCHEMBL5543263 0.67 PRKCI (0.39) ESR1ESR2HMGCRALOX5CYP3A4

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 ESR1 1578/4885ESR2 339/4885PTPN1 1427/4885

“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.