SCHEMBL13680570

SCHEMBL13680570

Cc1ccc(-c2ccn3ccnc3c2)o1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 1/20 0.39
GSK3B P49841 6/20 0.39
PIK3CD O00329 2/20 0.38
ABL1 P00519 2/20 0.38
EGFR P00533 2/20 0.38
HCK P08631 2/20 0.38
SRC P12931 2/20 0.38
PIK3CA P42336 2/20 0.38
PIK3CB P42338 2/20 0.38
MTOR P42345 2/20 0.38
PIK3CG P48736 2/20 0.38
EPHB4 P54760 2/20 0.38
PRKDC P78527 2/20 0.38
KDR P35968 1/20 0.38
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
DYRK1A Q13627 1/20 0.35
KDM4E B2RXH2 4/20 0.34
ALDH1A1 P00352 4/20 0.34
LMNA P02545 2/20 0.34

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
SCHEMBL13680719 0.78 DYRK1A (0.53) DYRK1AHPGDHSD17B10AXLFLT3
SCHEMBL3323702 0.74 PIK3C3 (0.39) PIK3C3PIK3CDABL1EGFRHCK
SCHEMBL10175031 0.74 FGFR3 (0.42) PIK3C3PIK3CDABL1EGFRHCK
SCHEMBL14826051 0.74 PIK3C3 (0.51) PIK3C3PIK3CDABL1EGFRHCK
SCHEMBL13680906 0.74 PIK3C3 (0.37) PIK3C3PIK3CDABL1EGFRHCK
SCHEMBL3185826 0.72 PIK3C3 (0.45) PIK3C3PIK3CDABL1EGFRHCK
SCHEMBL31380866 0.72 ADRA2A (0.48) CYP11B1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL13680536 0.71 TGFBR1 (0.53) PIK3C3PIK3CDABL1EGFRHCK
SCHEMBL557143 0.70 SMN1; SMN2 (0.44) PIK3C3PIK3CDABL1EGFRHCK
SCHEMBL3321672 0.70 CYP1A2 (0.41) PIK3C3PIK3CDABL1EGFRHCK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed