SCHEMBL3014791

SCHEMBL3014791

FC(F)(F)c1nc2ncncc2[nH]1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.57
HTT P42858 2/20 0.57
METAP2 P50579 1/20 0.44
METAP1 P53582 1/20 0.44
NPSR1 Q6W5P4 2/20 0.42
HCAR2 Q8TDS4 1/20 0.38
KDM4E B2RXH2 5/20 0.38
MAPT P10636 4/20 0.38
HPGD P15428 3/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.38
POLB P06746 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
ALOX15 P16050 1/20 0.37
CYP2C19 P33261 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL14336558 0.81 METAP2 (0.44) HSD17B10HTTMETAP2METAP1ALDH1A1
SCHEMBL2202798 0.81 METAP2 (0.44) HSD17B10HTTMETAP2METAP1NR3C1
SCHEMBL23452695 0.76 METAP2 (0.40) HSD17B10HTTMETAP2METAP1NR3C1
SCHEMBL10694869 0.75 METAP2 (0.39) HSD17B10HTTMETAP2METAP1NR3C1
SCHEMBL3801779 0.75 METAP2 (0.47) HSD17B10HTTMETAP2METAP1NPY5R
SCHEMBL5436671 0.74 METAP2 (0.41) HSD17B10HTTMETAP2METAP1NPY5R
SCHEMBL10552256 0.74 METAP2 (0.38) HSD17B10HTTMETAP2METAP1NR3C1
SCHEMBL23452690 0.74 METAP2 (0.38) HSD17B10HTTMETAP2METAP1NR3C1
SCHEMBL10600444 0.74 METAP2 (0.48) HSD17B10HTTMETAP2METAP1ALDH1A1
SCHEMBL11219412 0.73 HTT (1.00) HSD17B10HTTNPSR1HCAR2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1529049-A2 DERIVATIVES OF 2-TRIFLUORMETHYL-6-AMINOPURINE AS PHOSPHODIESTERASE 4 INHIBITORS Memory Pharmaceutical Corporation (US) 2005-05-11 EP claimed
WO-2004014913-A2 DERIVATIVES OF 2-TRIFLUORMETHYL-6-AMINOPURINE AS PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2004-02-19 WO claimed
EP-1383767-A1 TRIFLUOROMETHYLPURINES AS PHOSPHODIESTERASE 4 INHIBITORS Memory Pharmaceutical Corporation (US) 2004-01-28 EP claimed
WO-2002098878-A1 TRIFLUOROMETHYLPURINES AS PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2002-12-12 WO claimed
EP-2377865-B1 CYCLOBUTYL PURINE DERIVATIVE, ANGIOGENESIS PROMOTING AGENT, LUMENIZATION PROMOTING AGENT, NEUROCYTE GROWTH PROMOTING AGENT, AND DRUG UNIV KAGAWA NAT UNIV CORP (JP) 2014-12-17 EP disclosed
EP-1638559-B1 USE OF PYRAZOLOPYRIDINES FOR THE TREATMENT OF COGNITIVE DEFICITS EXONHIT THERAPEUTICS SA (FR) 2010-01-06 EP disclosed
US-7371737-B2 2-substituted-6-trifluoromethyl purine derivatives with adenosine-A3 antagonistic activity SOLVAY PHARMACEUTICALS, B.V. (NL) 2008-05-13 US disclosed
EP-1797092-A1 2-SUBSTITUTED-6-TRIFLUOROMETHYL PURINE DERIVATIVES WITH ADENOSINE-A3 ANTAGONISTIC ACTIVITY Solvay Pharmaceuticals B.V. (NL) 2007-06-20 EP disclosed
WO-2006027365-A1 2-SUBSTITUTED-6-TRIFLUOROMETHYL PURINE DERIVATIVES WITH ADENOSINE-A3 ANTAGONISTIC ACTIVITY SOLVAY PHARMACEUTICALS B.V. (NL) 2006-03-16 WO disclosed
US-20060052331-A1 2-Substituted-6-trifluoromethyl purine derivatives with adenosine-A3 antagonistic activity SOLVAY PHARMACEUTICALS B.V. (NL) 2006-03-09 US disclosed
EP-1529049-A2 DERIVATIVES OF 2-TRIFLUORMETHYL-6-AMINOPURINE AS PHOSPHODIESTERASE 4 INHIBITORS Memory Pharmaceutical Corporation (US) 2005-05-11 EP disclosed
WO-2004014913-A2 DERIVATIVES OF 2-TRIFLUORMETHYL-6-AMINOPURINE AS PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2004-02-19 WO disclosed
US-6511984-B2 For therapy of feeding disorders, cardiovascular diseases and other physiological disorders related to an excess of neuropeptide Y PFIZER INC. 2003-01-28 US disclosed
US-20020058671-A1 Neuropeptide Y antagonists ELLIOTT RICHARD L (US) 2002-05-16 US disclosed
EP-0538332-B1 POLYCYCLIC GUANINE DERIVATIVES SCHERING CORP (US) 1997-07-23 EP disclosed
US-5393755-A Hypotensive agents, enzyme inhibitors SCHERING CORPORATION (US) 1995-02-28 US disclosed
EP-0538332-A1 POLYCYCLIC GUANINE DERIVATIVES. SCHERING CORP (US) 1993-04-28 EP disclosed
WO-1991019717-A1 POLYCYCLIC GUANINE DERIVATIVES SCHERING CORPORATION (US) 1991-12-26 WO disclosed
EP-0395977-A1 Process for the preparation of 4-hydroxy-6-polyfluoroalkylpyrimidines LONZA AG (CH) 1990-11-07 EP 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-20020058671-A1 Neuropeptide Y antagonists NPY1R, NPY2R, GIPR HSD17B10 1548/4885HTT 1150/4885METAP2 1664/4885
US-20060052331-A1 2-Substituted-6-trifluoromethyl purine derivatives with adenosine-A3 antagonistic activity ADORA3, ADORA2A, ADORA2B HSD17B10 4423/4885HTT 4511/4885METAP2 391/4885

“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.