SCHEMBL14014273

SCHEMBL14014273

COc1cccc(-c2cc(-c3ccc(Oc4ccccc4)cc3)n3nc(C(=O)O)cc3n2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.65
ALDH1A1 P00352 7/20 0.65
MAPT P10636 4/20 0.60
LMNA P02545 3/20 0.60
MCL1 Q07820 3/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
GAA P10253 2/20 0.54
HPGD P15428 6/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
TP53 P04637 2/20 0.50
MAPK1 P28482 3/20 0.49
TSHR P16473 1/20 0.49
CASP1 P29466 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
RPA1 P27694 1/20 0.49
HSD17B10 Q99714 2/20 0.48
HTT P42858 2/20 0.48

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
SCHEMBL14014220 0.96 KDM4E (0.65) KDM4EALDH1A1MAPTLMNAMCL1
SCHEMBL14014274 0.95 KDM4E (0.70) KDM4EALDH1A1MAPTLMNAMCL1
SCHEMBL14014221 0.93 KDM4E (0.70) KDM4EALDH1A1MAPTLMNAMCL1
SCHEMBL14014254 0.90 KDM4E (0.73) KDM4EALDH1A1MAPTLMNAL3MBTL1
SCHEMBL14014257 0.90 KDM4E (0.81) KDM4EALDH1A1MAPTLMNAMCL1
SCHEMBL14014216 0.90 KDM4E (0.81) KDM4EALDH1A1MAPTLMNAMCL1
SCHEMBL14014249 0.89 KDM4E (0.79) KDM4EALDH1A1MAPTLMNAMCL1
SCHEMBL14014231 0.89 KDM4E (0.79) KDM4EALDH1A1MAPTLMNAMCL1
SCHEMBL14014230 0.89 KDM4E (0.78) KDM4EALDH1A1MAPTLMNAMCL1
SCHEMBL14014264 0.88 KDM4E (0.65) KDM4EALDH1A1MAPTLMNAMCL1

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 4 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
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