SCHEMBL16601548

SCHEMBL16601548

Cc1nc2ccc(-c3nn(C(C)C)c4ncnc(N)c34)cc2s1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 17/20 0.67
MTOR P42345 16/20 0.67
PIK3CD O00329 16/20 0.67
PIK3CA P42336 16/20 0.67
PIK3CB P42338 16/20 0.67
PIK3CG P48736 16/20 0.67
ABL1 P00519 16/20 0.67
PRKDC P78527 15/20 0.67
EGFR P00533 14/20 0.67
HCK P08631 14/20 0.67
KDR P35968 14/20 0.67
EPHB4 P54760 14/20 0.67
PI4KB Q9UBF8 6/20 0.64
BACE1 P56817 1/20 0.64
BMPR1B O00238 1/20 0.63
RIPK2 O43353 1/20 0.63
STK16 O75716 1/20 0.63
STK10 O94804 1/20 0.63
MAP4K4 O95819 1/20 0.63
RET P07949 1/20 0.63

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
SCHEMBL12607034 0.90 SRC (0.67) SRCMTORPIK3CDPIK3CAPIK3CB
SCHEMBL1785138 0.87 SRC (0.62) SRCMTORPIK3CDPIK3CAPIK3CB
SCHEMBL8008773 0.84 SRC (0.59) SRCMTORPIK3CDPIK3CAPIK3CB
SCHEMBL7997101 0.83 SRC (0.69) SRCMTORPIK3CDPIK3CAPIK3CB
SCHEMBL7997108 0.83 SRC (0.57) SRCMTORPIK3CDPIK3CAPIK3CB
SCHEMBL1787523 0.83 PIK3CD (0.62) SRCMTORPIK3CDPIK3CAPIK3CB
SCHEMBL8012348 0.82 SRC (0.56) SRCMTORPIK3CDPIK3CAPIK3CB
SCHEMBL8012344 0.82 PIK3CD (0.56) SRCMTORPIK3CDPIK3CAPIK3CB
SCHEMBL8008776 0.82 MTOR (0.57) SRCMTORPIK3CDPIK3CAPIK3CB
SCHEMBL19645242 0.82 SRC (0.67) SRCMTORPIK3CDPIK3CAPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8993580-B2 Benzothiazole kinase inhibitors and methods of use INTELLIKINE LLC (US) 2015-03-31 US disclosed