SCHEMBL14014669

SCHEMBL14014669

FC(F)(F)c1cc(COc2ccc(-c3cnc4c(-c5nnn[nH]5)cnn4c3C3CCCCC3)cc2)ccc1Cl

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 6/20 0.35
PTGDR2 Q9Y5Y4 2/20 0.35
PDE2A O00408 1/20 0.33
PLA2G7 Q13093 1/20 0.33
SLC6A4 P31645 1/20 0.33
SCN9A Q15858 2/20 0.32
ALOX5AP P20292 1/20 0.32
IDO1 P14902 2/20 0.32
PRMT5 O14744 1/20 0.32
GRM2 Q14416 1/20 0.31
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
TYK2 P29597 1/20 0.31
JAK3 P52333 1/20 0.31
KDM4C Q9H3R0 1/20 0.31

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
SCHEMBL14014628 0.92 PDE2A (0.33) S1PR1PDE2ASLC6A4ALOX5APPRMT5
SCHEMBL14014668 0.91 S1PR1 (0.36) S1PR1
SCHEMBL14014662 0.88 SCN1A (0.36) S1PR1PTGDR2SCN9AALOX5APGRM2
SCHEMBL14014665 0.87 ALOX5AP (0.33) ALOX5APPRMT5JAK2JAK3
SCHEMBL4710343 0.86 CYP3A4 (0.39) S1PR1ALOX5AP
SCHEMBL14014616 0.85 JAK1 (0.40) SLC6A4ALOX5APGRM2JAK1
SCHEMBL14014625 0.84 GPR119 (0.37) PDE2AALOX5APPRMT5GRM2
SCHEMBL14542125 0.83 CYP4F2 (0.35) PRMT5
SCHEMBL14014796 0.82 BMP4 (0.36) PRMT5
SCHEMBL14014586 0.82 PLAT (0.38)

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