SCHEMBL2023364

SCHEMBL2023364

CCOC(=O)c1nc2ccccc2nc1OC

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
HDAC6 Q9UBN7 1/20 0.49
MAPK1 P28482 2/20 0.48
POLB P06746 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 1/20 0.48
KDM4E B2RXH2 3/20 0.48
CYP1A2 P05177 1/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 2/20 0.45
TARBP2 Q15633 1/20 0.45
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
CASP3 P42574 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SENP7 Q9BQF6 1/20 0.44

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
SCHEMBL9084573 0.83 CYP1A2 (0.44) L3MBTL1MAPK1POLBALDH1A1HPGD
SCHEMBL2025252 0.82 LMNA (0.57) L3MBTL1MAPK1POLBALDH1A1HPGD
SCHEMBL8861207 0.81 TSHR (0.50) L3MBTL1MAPK1POLBALDH1A1HPGD
SCHEMBL5717618 0.80 ALDH1A1 (0.67) L3MBTL1HDAC6POLBALDH1A1HPGD
SCHEMBL31137919 0.80 ALDH1A1 (0.67) L3MBTL1HDAC6POLBALDH1A1HPGD
SCHEMBL31456120 0.79 KDM4E (0.50) L3MBTL1MAPK1POLBALDH1A1HPGD
SCHEMBL2019580 0.79 MAPT (0.49) L3MBTL1MAPK1POLBALDH1A1HPGD
SCHEMBL2024265 0.79 KDM4E (0.50) L3MBTL1MAPK1POLBALDH1A1HPGD
SCHEMBL4855010 0.79 TARBP2 (0.42) L3MBTL1MAPK1POLBALDH1A1HPGD
SCHEMBL6601700 0.78 ALDH1A1 (0.54) L3MBTL1MAPK1POLBALDH1A1HPGD

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-2350027-A1 TRI-SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS Mitsubishi Tanabe Pharma Corporation (JP) 2011-08-03 EP disclosed
US-20110160206-A1 TRI-SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-06-30 US disclosed
US-20110160206-A1 TRI-SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-06-30 US disclosed
US-20110160206-A1 TRI-SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-06-30 US disclosed
WO-2010027097-A1 TRI-SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-03-11 WO disclosed
WO-2010027097-A1 TRI-SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-03-11 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-20110160206-A1 TRI-SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS PDE10A, PDE12, PDE9A L3MBTL1 4608/4885HDAC6 1627/4885MAPK1 985/4885

“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.