SCHEMBL14014200

SCHEMBL14014200

COc1cccc(-c2cc(-c3ccc(F)cc3)nc3cc(C(=O)O)nn23)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.62
ALDH1A1 P00352 10/20 0.62
MAPT P10636 4/20 0.55
LMNA P02545 1/20 0.55
HSD17B10 Q99714 3/20 0.51
HPGD P15428 6/20 0.50
MAPK1 P28482 3/20 0.49
CASP1 P29466 2/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
TSHR P16473 1/20 0.49
ALDH1A3 P47895 1/20 0.49
CASP7 P55210 1/20 0.48
GAA P10253 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TP53 P04637 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL14014254 0.92 KDM4E (0.73) KDM4EALDH1A1MAPTLMNAHSD17B10
SCHEMBL14014191 0.90 KDM4E (0.62) KDM4EALDH1A1MAPTLMNAHSD17B10
SCHEMBL14014220 0.90 KDM4E (0.65) KDM4EALDH1A1MAPTLMNAHSD17B10
SCHEMBL14014213 0.89 KDM4E (0.64) KDM4EALDH1A1MAPTLMNAHSD17B10
SCHEMBL14014358 0.89 ALDH1A1 (0.58) KDM4EALDH1A1MAPTLMNAHSD17B10
SCHEMBL14014274 0.88 KDM4E (0.70) KDM4EALDH1A1MAPTLMNAHSD17B10
SCHEMBL14014197 0.87 KDM4E (0.70) KDM4EALDH1A1MAPTLMNAHSD17B10
SCHEMBL14014196 0.85 KDM4E (0.85) KDM4EALDH1A1MAPTLMNAHSD17B10
SCHEMBL14014246 0.85 KDM4E (0.59) KDM4EALDH1A1MAPTLMNAHSD17B10
SCHEMBL14014273 0.85 KDM4E (0.65) KDM4EALDH1A1MAPTLMNAHSD17B10

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