SCHEMBL4753186

SCHEMBL4753186

CCN1C(=O)[N]c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.41
HSD17B10 Q99714 1/20 0.41
CNR1 P21554 1/20 0.40
GPR55 Q9Y2T6 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
HPGD P15428 1/20 0.39
CASP1 P29466 1/20 0.39
MPI P34949 1/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 1/20 0.38
MAPT P10636 5/20 0.37
KDM4E B2RXH2 2/20 0.37
TP53 P04637 1/20 0.37
HTT P42858 1/20 0.37
MGLL Q99685 2/20 0.36
BACE1 P56817 1/20 0.36
BACE2 Q9Y5Z0 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
SCHEMBL7436460 1.00 ALDH1A1 (0.41) ALDH1A1HSD17B10CNR1GPR55MEN1
SCHEMBL4750501 0.85 ADRA2A (0.44) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL4754016 0.82 ALDH1A1 (0.46) ALDH1A1HSD17B10CNR1MEN1KMT2A
SCHEMBL6013595 0.81 ALDH1A1 (0.46) ALDH1A1HSD17B10CNR1GPR55MEN1
SCHEMBL5544626 0.81 ALDH1A1 (0.53) ALDH1A1CNR1MEN1KMT2AMGLL
SCHEMBL4753129 0.80 ALDH1A1 (0.43) ALDH1A1HSD17B10KMT2AHPGDCACNA1B
SCHEMBL5547622 0.80 CDC25A (0.54) ALDH1A1CNR1MEN1KMT2AMGLL
SCHEMBL2761355 0.78 ALDH1A1 (0.52) ALDH1A1HSD17B10MEN1KMT2ASMN1; SMN2
SCHEMBL14916405 0.78 MEN1 (0.47) ALDH1A1HSD17B10MEN1KMT2AHPGD
SCHEMBL299642 0.77 CASP3 (0.44) ALDH1A1MEN1KMT2APOLBMAPT

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 6 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
WO-2008146064-A1 NEW BENZOFURAN DERIVATIVES AS SELECTIVE 5HT7 RECEPTOR INHIBITORS AND PROCESS FOR THEIR PREPARATION EGIS GYÓGYSZERGYÁR (HU) 2008-12-04 WO 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 ALDH1A1 355/4885HSD17B10 467/4885CNR1 857/4885

“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.