SCHEMBL14014652

SCHEMBL14014652

c1ccc(Oc2ccc(-c3cnc4c(-c5nnn[nH]5)cnn4c3C3CCCCC3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 8/20 0.39
SRC P12931 7/20 0.39
TEK Q02763 6/20 0.39
BTK Q06187 5/20 0.39
KDR P35968 4/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LYN P07948 2/20 0.39
KDM4E B2RXH2 1/20 0.39
RGS12 O14924 1/20 0.39
GMNN O75496 1/20 0.39
ALDH1A1 P00352 1/20 0.39
EGFR P00533 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
FYN P06241 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL14014891 0.92 NPC1 (0.40) KDRNPC1RAB9AMEN1KMT2A
SCHEMBL14014650 0.92 LCK (0.41) LCKSRCTEKBTKKDR
SCHEMBL14541774 0.91 NPC1 (0.33) LCKSRCTEKBTKKDR
SCHEMBL14014639 0.90 TNK2 (0.38) LCKSRCTEKBTKKDR
SCHEMBL4709333 0.90 TNK2 (0.38) SRCBTKKDRNPC1RAB9A
SCHEMBL14014641 0.89 GABBR2 (0.37) NPC1RAB9AKMT2AGPR119
SCHEMBL14014697 0.89 NPC1 (0.32) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL14014643 0.89 GABBR2 (0.39) BTKNPC1RAB9AKMT2ATNK2
SCHEMBL14014550 0.89 TNK2 (0.41) BTKTNK2
SCHEMBL14014671 0.88 BTK (0.33) BTKNPC1RAB9AMEN1KMT2A

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