SCHEMBL5540098

SCHEMBL5540098

CC1(CN2CCN(Cc3ccc(Cl)cc3)C2=O)CO1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 1/20 0.52
ERCC4 Q92889 1/20 0.52
DRD3 P35462 1/20 0.48
KCNH2 Q12809 1/20 0.48
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HPGD P15428 1/20 0.44
LMNA P02545 2/20 0.43
POLB P06746 2/20 0.42
ALDH1A1 P00352 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
P2RX7 Q99572 1/20 0.41
TSHR P16473 1/20 0.41
GRM2 Q14416 1/20 0.41

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
SCHEMBL5547302 0.87 RAB9A (0.54) ERCC1ERCC4MEN1KMT2ALMNA
SCHEMBL5539132 0.87 HSD11B1 (0.46) ERCC1ERCC4DRD3KCNH2MEN1
SCHEMBL5539716 0.87 KMT2A (0.54) DRD3KCNH2MEN1KMT2AHPGD
SCHEMBL5545330 0.85 GAA (0.51) MEN1KMT2ALMNAPOLBALDH1A1
SCHEMBL5541465 0.72 KCNH2 (0.47) ERCC1ERCC4DRD3KCNH2MEN1
SCHEMBL18835681 0.72 ERCC1 (0.59) ERCC1ERCC4DRD3KCNH2MEN1
SCHEMBL15038459 0.71 ERCC1 (0.54) ERCC1ERCC4DRD3KCNH2MEN1
SCHEMBL4749240 0.71 ERCC1 (0.55) ERCC1ERCC4DRD3KCNH2MEN1
SCHEMBL5539273 0.70 BTK (0.47) MEN1KMT2ALMNAPOLBALDH1A1
SCHEMBL5544692 0.70 CHRM3 (0.53) DRD3

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 ERCC1 4149/4885ERCC4 4184/4885DRD3 132/4885

“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.