SCHEMBL703955

SCHEMBL703955

CCNc1ncc(C=c2sc(=CN=Nc3ccc(OCCN(C)C)cc3C)[nH]c2=O)s1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.32
PRKDC P78527 1/20 0.32
TNKS O95271 2/20 0.31
HPGD P15428 1/20 0.31
NUAK1 O60285 1/20 0.31
PARP1 P09874 2/20 0.30

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
SCHEMBL703954 1.00 PIK3CA (0.32) PIK3CAPRKDCTNKSHPGDNUAK1
SCHEMBL705496 0.88 PIK3CA (0.37) PIK3CAPRKDCPARP1
SCHEMBL705497 0.88 PIK3CA (0.37) PIK3CAPRKDCPARP1
SCHEMBL702258 0.86 SETD1B (0.33)
SCHEMBL702257 0.86 SETD1B (0.33)
SCHEMBL708157 0.84 SYK (0.35) PIK3CAPRKDCTNKSNUAK1PARP1
SCHEMBL708508 0.84 UTS2R (0.32) PIK3CAPRKDC
SCHEMBL708159 0.81 PIK3CA (0.35) PIK3CAPRKDCPARP1
SCHEMBL708156 0.81 PIK3CA (0.35) PIK3CAPRKDCPARP1
SCHEMBL701907 0.77 KDM4E (0.37) PARP1

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
EP-2423204-A1 THIAZOLIDINONE DERIVATIVE SBI Biotech Co., Ltd. (JP) 2012-02-29 EP disclosed