SCHEMBL14014682

SCHEMBL14014682

COc1cc(COc2ccc(-c3cnc4c(-c5nnn[nH]5)cnn4c3C3CCCCC3)cc2)cc(OC)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
KMT2A Q03164 3/20 0.36
KDR P35968 3/20 0.34
PLAT P00750 1/20 0.34
AXL P30530 2/20 0.33
TYRO3 Q06418 2/20 0.33
FLT3 P36888 1/20 0.33
MERTK Q12866 1/20 0.33
ALKBH1 Q13686 1/20 0.33
MAPT P10636 4/20 0.32
CHRM1 P11229 2/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 2/20 0.32
MEN1 O00255 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
NOD2 Q9HC29 1/20 0.32
STAT1 P42224 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL14014615 0.93 MAOB (0.37) NPC1RAB9AKMT2APLATALKBH1
SCHEMBL14014580 0.91 PLAT (0.38) KDRPLATAXLTYRO3FLT3
SCHEMBL14014686 0.88 ALOX5AP (0.33) NPC1RAB9AKMT2AAXLTYRO3
SCHEMBL14014681 0.88 PDE2A (0.34) NPC1RAB9AKMT2AKDRPLAT
SCHEMBL14014796 0.87 BMP4 (0.36) KMT2AKDRTYRO3FLT3MERTK
SCHEMBL14014679 0.87 ALOX5 (0.37) KDRPLATMAPTLMNAALOX5
SCHEMBL14014560 0.86 PLAT (0.40) KDRPLATAXLTYRO3FLT3
SCHEMBL14542125 0.86 CYP4F2 (0.35) KDRPLATMAPTMAPK1NPSR1
SCHEMBL14014668 0.86 S1PR1 (0.36) KMT2AALKBH1MAPK1MEN1HPGD
SCHEMBL4709333 0.86 TNK2 (0.38) NPC1RAB9AKMT2AKDRPLAT

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