SCHEMBL2437449

SCHEMBL2437449

Cc1nc2cccc(C)c2nc1-c1cc2nc(O)cc(O)n2n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.36
MAPT P10636 3/20 0.36
MAPK1 P28482 1/20 0.36
NPC1 O15118 6/20 0.33
ALDH1A1 P00352 4/20 0.33
HPGD P15428 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NFKB1 P19838 1/20 0.33
HTT P42858 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
PDE10A Q9Y233 5/20 0.33
KDM4E B2RXH2 5/20 0.33
PIM1 P11309 2/20 0.32
PIM2 Q9P1W9 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
GAA P10253 2/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL2439360 0.95 RAB9A (0.36) RAB9AMAPTMAPK1NPC1ALDH1A1
SCHEMBL2436498 0.86 PDE10A (0.41) RAB9AMAPTNPC1ALDH1A1HPGD
SCHEMBL2441971 0.83 KDM4E (0.41) RAB9AMAPTNPC1ALDH1A1HPGD
SCHEMBL2438730 0.80 MAPT (0.38) RAB9AMAPTNPC1ALDH1A1HPGD
SCHEMBL2409936 0.80 DPP4 (0.36) RAB9AMAPTMAPK1NPC1ALDH1A1
SCHEMBL2437455 0.79 KDM4E (0.41) RAB9AMAPTNPC1ALDH1A1HPGD
SCHEMBL2440003 0.79 KDM4E (0.41) RAB9AMAPTNPC1ALDH1A1HPGD
SCHEMBL14119712 0.77 PDE10A (0.47) RAB9AMAPTMAPK1NPC1ALDH1A1
SCHEMBL2440500 0.76 MIF (0.47) RAB9AMAPTNPC1ALDH1A1HPGD
SCHEMBL2440809 0.75 DPP4 (0.36) RAB9AMAPTMAPK1NPC1ALDH1A1

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-2539342-B1 PYRAZOLOPYRIMIDINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS MITSUBISHI TANABE PHARMA CORP (JP) 2015-04-15 EP disclosed
US-8969376-B2 Pyrazolopyrimidine compounds and their use as PDE10 inhibitors MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-03-03 US disclosed
EP-2539342-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS Mitsubishi Tanabe Pharma Corporation (JP) 2013-01-02 EP disclosed
US-20120309754-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-12-06 US disclosed
WO-2011105628-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-09-01 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-20120309754-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS PDE3B, PDE3A, PDE5A RAB9A 745/4885MAPT 4404/4885MAPK1 286/4885

“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.