SCHEMBL14014272

SCHEMBL14014272

COc1ccc(-c2cc(-c3ccc(Cl)cc3)nc3cc(C(=O)O)nn23)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.58
KDM4E B2RXH2 6/20 0.57
ALDH1A1 P00352 4/20 0.57
MAPT P10636 6/20 0.55
TSHR P16473 1/20 0.55
MAPK1 P28482 1/20 0.55
CASP1 P29466 1/20 0.55
HPGD P15428 2/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
LMNA P02545 2/20 0.51
KMO O15229 2/20 0.50
TTR P02766 1/20 0.50
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44

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
SCHEMBL14014284 0.92 TP53 (0.58) TP53KDM4EALDH1A1MAPTTSHR
SCHEMBL14014319 0.90 TP53 (0.57) TP53KDM4EALDH1A1MAPTTSHR
SCHEMBL14014271 0.90 MAPT (0.56) TP53KDM4EALDH1A1MAPTTSHR
SCHEMBL14014289 0.89 MAPT (0.61) TP53KDM4EALDH1A1MAPTTSHR
SCHEMBL14014301 0.89 TP53 (0.58) TP53KDM4EALDH1A1MAPTTSHR
SCHEMBL14014356 0.87 MAPT (0.56) TP53KDM4EALDH1A1MAPTTSHR
SCHEMBL14014369 0.87 TTR (0.65) TP53KDM4EALDH1A1MAPTMAPK1
SCHEMBL14014192 0.86 KDM4E (0.64) TP53KDM4EALDH1A1MAPTTSHR
SCHEMBL14014189 0.85 KDM4E (0.77) TP53KDM4EALDH1A1MAPTMAPK1
SCHEMBL14014346 0.85 TP53 (0.54) TP53KDM4EALDH1A1MAPTTSHR

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