SCHEMBL14014304

SCHEMBL14014304

COc1cc(F)cc(-c2cc(-c3ccc(C(F)(F)F)cc3)nc3cc(C(=O)O)nn23)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.56
ALDH1A1 P00352 8/20 0.56
MAPT P10636 5/20 0.53
CASP1 P29466 4/20 0.53
TSHR P16473 2/20 0.53
MAPK1 P28482 1/20 0.53
HSD17B10 Q99714 5/20 0.52
HPGD P15428 4/20 0.52
CASP7 P55210 2/20 0.52
MEN1 O00255 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
TTR P02766 1/20 0.46
GAA P10253 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL14014275 0.89 ALDH1A1 (0.62) KDM4EALDH1A1MAPTCASP1TSHR
SCHEMBL14014358 0.85 ALDH1A1 (0.58) KDM4EALDH1A1MAPTCASP1TSHR
SCHEMBL14014306 0.83 MAPT (0.62) KDM4EALDH1A1MAPTCASP1TSHR
SCHEMBL14014355 0.82 KDM4E (0.54) KDM4EALDH1A1MAPTCASP1TSHR
SCHEMBL14014213 0.81 KDM4E (0.64) KDM4EALDH1A1MAPTCASP1TSHR
SCHEMBL25337825 0.81 KDM4E (0.79) KDM4EALDH1A1MAPTCASP1TSHR
SCHEMBL14014288 0.81 MAPT (0.61) KDM4EALDH1A1MAPTCASP1TSHR
SCHEMBL14014289 0.81 MAPT (0.61) KDM4EALDH1A1MAPTCASP1TSHR
SCHEMBL14014303 0.81 ALDH1A1 (0.59) KDM4EALDH1A1MAPTCASP1TSHR
SCHEMBL14014283 0.80 KDM4E (0.77) KDM4EALDH1A1MAPTCASP1TSHR

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
US-7449488-B2 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION (US) 2008-11-11 US disclosed
US-7449488-B2 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION (US) 2008-11-11 US disclosed
WO-2007044410-A1 PYRAZOLO [1,5-A] PYRIMIDINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2007-04-19 WO disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed