SCHEMBL3256367

SCHEMBL3256367

CS(=O)(=O)CCC(N)c1ccc(-n2nc(-c3ccc4[nH]c(Cc5ccccc5)nc4c3)c3c(N)ncnc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 11/20 0.45
▸ EGFR P00533 3/20 0.45
▸ ERBB2 P04626 1/20 0.45
▸ SRC P12931 4/20 0.42
▸ ATR Q13535 1/20 0.41
▸ FYN P06241 1/20 0.40
▸ PIK3CD O00329 2/20 0.38
▸ PIK3CA P42336 2/20 0.38
▸ PIK3CB P42338 2/20 0.38
▸ PIK3CG P48736 2/20 0.38
▸ PRKDC P78527 2/20 0.38
▸ ABL1 P00519 2/20 0.38
▸ KDR P35968 2/20 0.38
▸ RET P07949 1/20 0.38
▸ HCK P08631 1/20 0.38
▸ MTOR P42345 1/20 0.38
▸ EPHB4 P54760 1/20 0.38

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
SCHEMBL2959517 0.85 IGF1R (0.45) IGF1REGFRERBB2SRCATR
SCHEMBL2967036 0.79 IGF1R (0.59) IGF1REGFRERBB2
SCHEMBL2959491 0.77 IGF1R (0.59) IGF1REGFRERBB2
SCHEMBL2959065 0.76 SRC (0.60) IGF1REGFRERBB2SRCFYN
SCHEMBL2957993 0.76 IGF1R (0.62) IGF1REGFRERBB2
SCHEMBL2956433 0.75 IGF1R (0.60) IGF1REGFRERBB2KDR
SCHEMBL2956438 0.75 IGF1R (0.60) IGF1REGFRERBB2KDR
SCHEMBL2965040 0.75 IGF1R (0.60) IGF1REGFRERBB2KDR
SCHEMBL2955758 0.75 IGF1R (0.64) IGF1REGFRERBB2SRCATR
SCHEMBL2959425 0.74 IGF1R (0.63) IGF1REGFRERBB2

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-7772231-B2 Substituted pyrazolo[3,4-d]pyrimidines as protein kinase inhibitors ABBOTT LABORATORIES (US) 2010-08-10 — — US claimed
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