SCHEMBL14014192

SCHEMBL14014192

COc1ccc(-c2cc(-c3ccc(Cl)cc3)nc3cc(C(=O)O)nn23)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.64
ALDH1A1 P00352 5/20 0.64
GAA P10253 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
MAPT P10636 4/20 0.58
LMNA P02545 1/20 0.58
HPGD P15428 4/20 0.54
CASP1 P29466 3/20 0.54
HSD17B10 Q99714 3/20 0.54
CASP7 P55210 2/20 0.54
TP53 P04637 3/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
ATM Q13315 1/20 0.53
CYP3A4 P08684 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53
MARS1 P56192 1/20 0.52
RPA1 P27694 1/20 0.51
TSHR P16473 2/20 0.50

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
SCHEMBL14014249 0.91 KDM4E (0.79) KDM4EALDH1A1GAAL3MBTL1MAPT
SCHEMBL14014189 0.91 KDM4E (0.77) KDM4EALDH1A1GAAL3MBTL1MAPT
SCHEMBL14014191 0.89 KDM4E (0.62) KDM4EALDH1A1GAAL3MBTL1MAPT
SCHEMBL14014260 0.89 KDM4E (0.62) KDM4EALDH1A1GAAL3MBTL1MAPT
SCHEMBL14014213 0.89 KDM4E (0.64) KDM4EALDH1A1GAAL3MBTL1MAPT
SCHEMBL14014210 0.88 MARS1 (0.63) KDM4EALDH1A1GAAL3MBTL1MAPT
SCHEMBL6211856 0.88 KDM4E (0.70) KDM4EALDH1A1GAAL3MBTL1MAPT
SCHEMBL14014221 0.88 KDM4E (0.70) KDM4EALDH1A1GAAL3MBTL1MAPT
SCHEMBL14014219 0.88 KDM4E (0.70) KDM4EALDH1A1GAAL3MBTL1MAPT
SCHEMBL14014105 0.87 KDM4E (0.85) KDM4EALDH1A1GAAL3MBTL1MAPT

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