SCHEMBL14014107

SCHEMBL14014107

O=C(O)c1cnn2c(-c3ccc(Cl)cc3)cc(-c3ccccc3)nc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.55
KDM4E B2RXH2 9/20 0.53
ALDH1A1 P00352 6/20 0.53
HPGD P15428 6/20 0.53
MEN1 O00255 1/20 0.53
HTT P42858 1/20 0.53
KMT2A Q03164 1/20 0.53
CTRC Q99895 1/20 0.52
LMNA P02545 2/20 0.51
ABCB1 P08183 1/20 0.51
ABCC1 P33527 1/20 0.51
HSD17B10 Q99714 5/20 0.50
MAPK1 P28482 1/20 0.50
MAPT P10636 1/20 0.50
POLB P06746 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
PPARA Q07869 1/20 0.47
THRB P10828 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
SCHEMBL14014090 1.00 TP53 (0.55) TP53KDM4EALDH1A1HPGDMEN1
SCHEMBL3279474 0.92 KDM4E (0.58) TP53KDM4EALDH1A1HPGDMEN1
SCHEMBL14014094 0.90 KDM4E (0.57) TP53KDM4EALDH1A1HPGDMEN1
SCHEMBL14014087 0.86 KDM4E (0.72) TP53KDM4EALDH1A1HPGDMEN1
SCHEMBL14014039 0.86 KDM4E (0.72) TP53KDM4EALDH1A1HPGDMEN1
SCHEMBL5036200 0.84 KDM4E (0.54) TP53KDM4EALDH1A1HPGDMEN1
SCHEMBL14014089 0.84 KDM4E (0.49) TP53KDM4EALDH1A1HPGDMEN1
SCHEMBL14014091 0.83 KDM4E (0.64) TP53KDM4EALDH1A1HPGDMEN1
SCHEMBL313356 0.83 KDM4E (0.53) TP53KDM4EALDH1A1HPGDMEN1
SCHEMBL312424 0.82 KDM4E (0.60) TP53KDM4EALDH1A1HPGDMEN1

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