SCHEMBL4473998

SCHEMBL4473998

Nc1nc2cc(O)ccc2o1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.61
CYP1A2 P05177 1/20 0.61
MAPT P10636 1/20 0.61
THRB P10828 1/20 0.61
ALOX15 P16050 1/20 0.61
MAPK1 P28482 1/20 0.61
ESR1 P03372 9/20 0.58
ESR2 Q92731 9/20 0.58
PIK3CA P42336 4/20 0.57
PIK3CB P42338 3/20 0.57
PIK3CG P48736 2/20 0.47
APP P05067 2/20 0.43
FLT3 P36888 1/20 0.43
PIK3CD O00329 1/20 0.42
ENPP2 Q13822 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
SCHEMBL28572767 0.85 ESR1 (0.56) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL30387063 0.85 ESR1 (0.56) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL6398262 0.79 MAPT (0.66) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL12850681 0.79 LMNA (0.66) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL7891196 0.77 MAPT (0.58) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL29954485 0.77 MAPT (0.58) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL12927715 0.77 MAPT (0.58) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL12778281 0.76 ESR1 (0.58) ESR1ESR2PIK3CAPIK3CBAPP
Zoxazolamine SCHEMBL10891033 0.76 LMNA (1.00) LMNACYP1A2MAPTTHRBALOX15
Zoxazolamine SCHEMBL251567 0.76 LMNA (1.00) LMNACYP1A2MAPTTHRBALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1717230-B1 FUSED-RING 4-OXOPYRIMIDINE DERIVATIVE MSD KK (JP) 2014-08-06 EP disclosed
US-8268842-B2 Fused ring 4-oxopyrimidine derivative MSD K.K. (JP) 2012-09-18 US disclosed
CN-1918128-B fused ring 4-oxo-pyrimidine derivatives BANYU PHARMA CO LTD 2011-01-26 CN disclosed
US-20090209562-A1 Fused ring 4-oxopyrimidine derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-08-20 US disclosed
US-7521455-B2 Fused ring 4-oxopyrimidine derivative BANYU PHARMACEUTICAL CO. LTD. (JP) 2009-04-21 US disclosed
CN-1918128-A Fused ring 4-oxo-pyrimidine derivatives BANYU PHARMA CO LTD (JP) 2007-02-21 CN disclosed
EP-1717230-A1 FUSED-RING 4-OXOPYRIMIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-02 EP disclosed
US-20050182045-A1 Fused ring 4-oxopyrimidine derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-08-18 US 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 (2 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-20050182045-A1 Fused ring 4-oxopyrimidine derivative HRH4, HRH2, HRH3 LMNA 4856/4885CYP1A2 720/4885MAPT 3669/4885
US-20090209562-A1 Fused ring 4-oxopyrimidine derivative HRH4, HRH2, HRH3 LMNA 4856/4885CYP1A2 720/4885MAPT 3669/4885

“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.