SCHEMBL14014114

SCHEMBL14014114

CCOC(=O)c1cnn2c(C)cc(-c3ccc(OCC)cc3)nc12

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.78
HPGD P15428 9/20 0.78
HSD17B10 Q99714 9/20 0.78
ALDH1A1 P00352 9/20 0.78
RAB9A P51151 5/20 0.78
NPC1 O15118 4/20 0.78
SMN1; SMN2 Q16637 4/20 0.78
MAPT P10636 3/20 0.59
CASP1 P29466 4/20 0.59
TSHR P16473 3/20 0.59
CASP7 P55210 2/20 0.59
POLB P06746 2/20 0.53
AHR P35869 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
GAA P10253 2/20 0.48
GLA P06280 1/20 0.48
USP2 O75604 2/20 0.46
TP53 P04637 2/20 0.46
MEN1 O00255 1/20 0.46

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
SCHEMBL24533246 0.89 KDM4E (0.62) KDM4EHPGDHSD17B10ALDH1A1RAB9A
SCHEMBL19436616 0.88 HSD17B10 (0.77) KDM4EHPGDHSD17B10ALDH1A1RAB9A
SCHEMBL29929515 0.88 HSD17B10 (0.77) KDM4EHPGDHSD17B10ALDH1A1RAB9A
SCHEMBL19436789 0.88 ALDH1A1 (1.00) KDM4EHPGDHSD17B10ALDH1A1RAB9A
SCHEMBL312337 0.88 KDM4E (0.80) KDM4EHPGDHSD17B10ALDH1A1RAB9A
SCHEMBL19436704 0.88 KDM4E (0.76) KDM4EHPGDHSD17B10ALDH1A1RAB9A
SCHEMBL14014110 0.87 KDM4E (1.00) KDM4EHPGDHSD17B10ALDH1A1RAB9A
SCHEMBL19436758 0.86 KDM4E (0.81) KDM4EHPGDHSD17B10ALDH1A1RAB9A
SCHEMBL19436709 0.82 KDM4E (0.81) KDM4EHPGDHSD17B10ALDH1A1RAB9A
SCHEMBL29929434 0.82 ALDH1A1 (0.77) KDM4EHPGDHSD17B10ALDH1A1RAB9A

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