SCHEMBL12580672

SCHEMBL12580672

CCC(Nc1nc(Nc2ccc(N=Nc3cccc(S(=O)(=O)O)c3)cc2OC)nc(Nc2ccc(N=Nc3cccc(S(=O)(=O)O)c3)cc2OCCCS(=O)(=O)O)n1)S(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAD52 P43351 1/20 0.32
▸ NCOA3 Q9Y6Q9 1/20 0.32
▸ PTK2 Q05397 3/20 0.31
▸ EGFR P00533 2/20 0.31
▸ LRRK2 Q5S007 1/20 0.31
▸ ALK Q9UM73 2/20 0.31
▸ BMPR1B O00238 1/20 0.31
▸ PLK4 O00444 1/20 0.31
▸ GAK O14976 1/20 0.31
▸ ERN1 O75460 1/20 0.31
▸ STK10 O94804 1/20 0.31
▸ ABL1 P00519 1/20 0.31
▸ INSR P06213 1/20 0.31
▸ LCK P06239 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ NPM1 P06748 1/20 0.31
▸ FES P07332 1/20 0.31
▸ YES1 P07947 1/20 0.31
▸ IGF1R P08069 1/20 0.31
▸ HCK P08631 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
SCHEMBL12330360 0.91 ALK (0.33) RAD52NCOA3PTK2EGFRLRRK2
SCHEMBL12580803 0.89 PHLPP2 (0.36) RAD52NCOA3PTK2EGFRLRRK2
SCHEMBL13218942 0.89 PHLPP2 (0.34) RAD52NCOA3PTK2EGFRALK
SCHEMBL13219057 0.89 PHLPP2 (0.36) RAD52NCOA3PTK2EGFRLRRK2
SCHEMBL12580671 0.88 ALK (0.32) RAD52NCOA3PTK2EGFRLRRK2
SCHEMBL12580674 0.88 LMNA (0.34) RAD52NCOA3PTK2EGFRLRRK2
SCHEMBL18820790 0.86 GBA1 (0.39) RAD52PTK2EGFRLRRK2
SCHEMBL13219050 0.85 PHLPP2 (0.34) PTK2EGFRLRRK2ALKBMPR1B
SCHEMBL13219166 0.85 FUT8 (0.36) PTK2EGFRALKBMPR1BPLK4
SCHEMBL13218922 0.85 ENPP2 (0.35) PTK2EGFRALKBMPR1BPLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110141186-A1 INK SET, INK CARTRIDGE, INK JET RECORDING METHOD, AND INK JET RECORDING APPARATUS CANON KABUSHIKI KAISHA (JP) 2011-06-16 — — US disclosed
US-7771525-B2 Water-soluble azo compound or salt thereof, ink composition and colored product NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-08-10 — — US disclosed
US-20100068475-A1 WATER-SOLUBLE AZO COMPOUND OR SALT THEREOF, INK COMPOSITION AND COLORED PRODUCT NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-03-18 — — US disclosed
US-7553358-B2 Ink jet ink, ink jet recording method, ink cartridge, recording unit and ink jet recording apparatus CANON KABUSHIKI KAISHA (JP) 2009-06-30 — — US disclosed
US-20080274285-A1 INK JET INK, INK JET RECORDING METHOD, INK CARTRIDGE, RECORDING UNIT AND INK JET RECORDING APPARATUS CANON KABUSHIKI KAISHA (JP) 2008-11-06 — — US disclosed
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