SCHEMBL2084738

SCHEMBL2084738

CCOC(=O)c1c(N)n[nH]c1C(F)F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.50
HTT P42858 2/20 0.50
MAPK10 P53779 1/20 0.50
PDE4D Q08499 1/20 0.49
ALDH1A1 P00352 7/20 0.44
HPGD P15428 6/20 0.44
MAPT P10636 4/20 0.44
GAA P10253 2/20 0.44
KDM4E B2RXH2 4/20 0.42
KMT2A Q03164 4/20 0.42
POLB P06746 3/20 0.42
MEN1 O00255 1/20 0.41
RECQL P46063 1/20 0.41
FHIT P49789 1/20 0.41
LMNA P02545 1/20 0.40
PKM P14618 1/20 0.40
HSD17B10 Q99714 3/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL19328 0.84 PDE4D (0.65) SMN1; SMN2HTTMAPK10PDE4DALDH1A1
SCHEMBL15165757 0.83 PDE4D (0.50) SMN1; SMN2HTTMAPK10PDE4DALDH1A1
SCHEMBL20583553 0.82 PDE4D (0.49) SMN1; SMN2HTTMAPK10PDE4DALDH1A1
SCHEMBL4650693 0.79 KDM4E (0.52) SMN1; SMN2HTTMAPK10PDE4DALDH1A1
SCHEMBL942577 0.79 PDE4D (0.56) SMN1; SMN2HTTMAPK10PDE4DALDH1A1
SCHEMBL600955 0.79 PDE4D (0.71) SMN1; SMN2HTTMAPK10PDE4DALDH1A1
SCHEMBL11160154 0.78 SMN1; SMN2 (0.55) SMN1; SMN2HTTMAPK10PDE4DALDH1A1
SCHEMBL20709978 0.76 SMN1; SMN2 (0.53) SMN1; SMN2HTTMAPK10PDE4DALDH1A1
SCHEMBL17781303 0.76 SMN1; SMN2 (0.53) SMN1; SMN2HTTMAPK10PDE4DALDH1A1
SCHEMBL4125363 0.76 SMN1; SMN2 (0.50) SMN1; SMN2HTTMAPK10PDE4DALDH1A1

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
US-8921380-B2 Pyrazolo[1,5-a] pyrimidine compounds as CB1 receptor antagonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-12-30 US disclosed
EP-2035427-B1 PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST MITSUBISHI TANABE PHARMA CORP (JP) 2013-12-11 EP disclosed
EP-2520577-A1 Pyrazolo[1,5-a]pyrimidine compounds as CB1 receptor antagonists Mitsubishi Tanabe Pharma Corporation (JP) 2012-11-07 EP disclosed
US-20120202992-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST TANIMOTO KOICHI (JP) 2012-08-09 US disclosed
US-8188097-B2 Pyrazolo[1,5-A]pyrimidine compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-05-29 US disclosed
US-8163759-B2 Pyrazolo[1,5-A] pyrimidine compounds as CB1 receptor antagonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-04-24 US disclosed
US-20090258867-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-15 US disclosed
EP-2035427-A2 PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST Mitsubishi Tanabe Pharma Corporation (JP) 2009-03-18 EP disclosed
US-20090069298-A1 Pyrazolo[1,5-A]Pyrimidine Compounds TANABE SEIYAKU CO., LTD. (JP) 2009-03-12 US disclosed
WO-2008004698-A2 PYRAZOLO [1, 5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-01-10 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 (3 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-20120202992-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST CNR1, CNR2, CCKAR SMN1; SMN2 4089/4885HTT 3446/4885MAPK10 934/4885
US-20090258867-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST CNR1, CNR2, CCKAR SMN1; SMN2 4292/4885HTT 3430/4885MAPK10 1036/4885
US-20090069298-A1 Pyrazolo[1,5-A]Pyrimidine Compounds RECQL, QTRT1, DPYD SMN1; SMN2 3307/4885HTT 2012/4885MAPK10 688/4885

“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.