SCHEMBL5537237

SCHEMBL5537237

Cc1ccnn1-c1ccccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.43
RIPK1 Q13546 1/20 0.41
NR3C2 P08235 1/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPK14 Q16539 3/20 0.39
KCNN4 O15554 2/20 0.39
MAPK11 Q15759 1/20 0.39
PDE4B Q07343 1/20 0.39
HSP90AA1 P07900 1/20 0.39
OPRM1 P35372 1/20 0.38
NOTUM Q6P988 1/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
TYK2 P29597 1/20 0.38
JAK3 P52333 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MGLL Q99685 1/20 0.37

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
SCHEMBL18706959 0.82 RIPK1 (0.45) RIPK1KDM4EKCNN4NOTUM
SCHEMBL29804492 0.82 RIPK1 (0.45) RIPK1KDM4EKCNN4NOTUM
SCHEMBL29452573 0.78 LMNA (0.47) PKMOPRM1NOTUM
SCHEMBL27385892 0.77 KDM5A (0.35) KDM4EALDH1A1
SCHEMBL14696532 0.77 HSP90AA1 (0.44) PKMRIPK1NR3C2MAPK14KCNN4
SCHEMBL10992734 0.77 POLB (0.55) PKMNR3C2KDM4EMAPK14MAPK11
SCHEMBL15554413 0.77 NR3C2 (0.40) PKMNR3C2MAPK14KCNN4MAPK11
SCHEMBL5537229 0.77 NR3C2 (0.40) PKMNR3C2MAPK14KCNN4MAPK11
SCHEMBL28692186 0.77 OPRM1 (0.38) KDM4EKCNN4OPRM1JAK2JAK1
Hydrochloric Acid SCHEMBL11473793 0.76 POLB (0.53) PKMNR3C2KDM4EMAPK14MAPK11

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 PKM 4291/4885RIPK1 1770/4885NR3C2 13/4885

“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.