SCHEMBL14014356

SCHEMBL14014356

COc1cccc(-c2cc(-c3ccc(OC)c(Cl)c3)n3nc(C(=O)O)cc3n2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
LMNA P02545 2/20 0.56
TP53 P04637 2/20 0.56
KDM4E B2RXH2 3/20 0.55
ALDH1A1 P00352 2/20 0.55
TSHR P16473 1/20 0.53
MAPK1 P28482 1/20 0.53
CASP1 P29466 1/20 0.53
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
HPGD P15428 1/20 0.51
CYP2C19 P33261 1/20 0.51
TTR P02766 1/20 0.48
KMO O15229 2/20 0.48
NSD2 O96028 1/20 0.48
NSD1 Q96L73 1/20 0.48
NSD3 Q9BZ95 1/20 0.48
LPAR5 Q9H1C0 1/20 0.48
HPSE Q9Y251 1/20 0.48
FYN P06241 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
SCHEMBL14014319 0.91 TP53 (0.57) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL14014301 0.89 TP53 (0.58) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL14014246 0.88 KDM4E (0.59) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL14014191 0.88 KDM4E (0.62) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL14014272 0.87 TP53 (0.58) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL14014274 0.87 KDM4E (0.70) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL14014254 0.87 KDM4E (0.73) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL14014357 0.86 ALDH1A1 (0.59) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL14014239 0.84 KDM4E (0.57) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL14014273 0.84 KDM4E (0.65) MAPTLMNATP53KDM4EALDH1A1

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