SCHEMBL375291

SCHEMBL375291

O=c1c2ccccc2nc(O)c2cccn12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
ALDH1A1 P00352 3/20 0.57
GLA P06280 2/20 0.57
GAA P10253 2/20 0.57
HSD17B10 Q99714 3/20 0.56
CASP1 P29466 1/20 0.56
CASP7 P55210 1/20 0.56
CHEK1 O14757 1/20 0.47
CDK5 Q00535 1/20 0.47
CDK5R1 Q15078 1/20 0.47
HPGD P15428 3/20 0.46
POLB P06746 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
MAPK1 P28482 1/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
LMNA P02545 3/20 0.43

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
SCHEMBL24734786 0.79 PTPN1 (0.61) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL2427657 0.73 KDM4E (1.00) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL18631335 0.72 KDM4E (1.00) KDM4ESMN1; SMN2ALDH1A1GLAGAA
Hydrochloric Acid SCHEMBL30228536 0.71 KDM4E (0.96) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL28665936 0.71 KDM4E (0.64) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL3547426 0.70 KDM4E (0.49) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL21836069 0.70 KDM4E (0.79) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL7207846 0.70 KDM4E (0.44) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL29013081 0.69 KDM4E (0.54) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL10806873 0.69 KDM4E (0.58) KDM4ESMN1; SMN2ALDH1A1GLAGAA

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1720881-B9 11-HYDROXY-5H-PYRROLO[2,1-C][1,4]BENZODIAZEPIN-5-ONE DERIVATIVES AS KEY INTERMEDIATES FOR THE PREPARATION OF C2 SUBSTITUTED PYRROLOBENZODIAZEPINS SPIROGEN SARL (CH) 2013-04-17 EP disclosed
EP-1720881-B8 11-HYDROXY-5H-PYRROLO[2,1-C][1,4]BENZODIAZEPIN-5-ONE DERIVATIVES AS KEY INTERMEDIATES FOR THE PREPARATION OF C2 SUBSTITUTED PYRROLOBENZODIAZEPINS SPIROGEN SARL (CH) 2013-01-16 EP disclosed
EP-1720881-B1 11-HYDROXY-5H-PYRROLO[2,1-C][1,4]BENZODIAZEPIN-5-ONE DERIVATIVES AS KEY INTERMEDIATES FOR THE PREPARATION OF C2 SUBSTITUTED PYRROLOBENZODIAZEPINS SPIROGEN LTD (GB) 2012-12-12 EP disclosed
EP-2270010-B1 11-hydroxy-5h-pyrrolo[2,1-c][1,4]benzodiazepin-5-one derivatives as key intermediates for the preparation of c2 substituted pyrrolobenzodiazepins SPIROGEN LTD (GB) 2012-01-25 EP disclosed
JP-2011157367-A 11-HYDROXY-5H-PYRROLO[2,1-C][1,4] BENZODIAZEPINE-5-ONE DERIVATIVE AS KEY INTERMEDIATE FOR PREPARATION OF C2 SUBSTITUTED PYRROLOBENZODIAZEPINE SPIROGEN LTD 2011-08-18 JP disclosed
EP-2270010-A1 11-HYDROXY-5H-PYRROLO[2,1-C][1,4]BENZODIAZEPIN-5-ONE DERIVATIVES AS KEY INTERMEDIATES FOR THE PREPARATION OF C2 SUBSTITUTED PYRROLOBENZODIAZEPINS Spirogen Limited (GB) 2011-01-05 EP disclosed
US-7741319-B2 11-hydroxy-5h-pyrrolo[2,1-c][1,4] benzodiazepin-5-one derivatives as key intermediates for the preparation of c2 substituted pyrrolobenzodiazepines SPIROGEN LIMITED (GB) 2010-06-22 US disclosed
US-20070173497-A1 11-Hydroxy-5h-pyrrolo[2,1-c][1,4] benzodiazepin-5-one derivatives as key intermediates for the preparation of c2 substituted pyrrolobenzodiazepines SPIROGEN LIMITED (GB) 2007-07-26 US disclosed
EP-1720881-A1 11-HYDROXY-5H-PYRROLO[2,1-C][1,4]BENZODIAZEPIN-5-ONE DERIVATIVES AS KEY INTERMEDIATES FOR THE PREPARATION OF C2 SUBSTITUTED PYRROLOBENZODIAZEPINS Spirogen Limited (GB) 2006-11-15 EP disclosed
WO-2005085251-A1 11-HYDROXY-5H-PYRROLO[2,1-C][1,4]BENZODIAZEPIN-5-ONE DERIVATIVES AS KEY INTERMEDIATES FOR THE PREPARATION OF C2 SUBSTITUTED PYRROLOBENZODIAZEPINES SPIROGEN LIMITED (GB) 2005-09-15 WO 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-20070173497-A1 11-Hydroxy-5h-pyrrolo[2,1-c][1,4] benzodiazepin-5-one derivatives as key intermediates for the preparation of c2 substituted pyrrolobenzodiazepines H1-10, DRD1, SBDS KDM4E 1229/4885SMN1; SMN2 1810/4885ALDH1A1 844/4885

“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.