SCHEMBL15468579

SCHEMBL15468579

COc1cc(N=Nc2cccc(S(=O)(=O)O)c2)ccc1Nc1nc(NCS(=O)(=O)O)nc(Nc2ccc(N=Nc3cccc(S(=O)(=O)O)c3)cc2O)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ MAPT P10636 2/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ PHLPP2 Q6ZVD8 1/20 0.37
▸ PTGS1 P23219 2/20 0.37
▸ PTGS2 P35354 2/20 0.37
▸ CA12 O43570 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA9 Q16790 2/20 0.36
▸ GBA1 P04062 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ ALOX12 P18054 1/20 0.35

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
SCHEMBL12580674 0.88 LMNA (0.34) GAAKMT2AMAPTMAPK1TDP1
SCHEMBL10155970 0.85 GBA1 (0.49) GBA1POLBNPC1RAB9A
SCHEMBL14553927 0.83 SENP3 (0.42) GAAKMT2AMAPTMAPK1TDP1
SCHEMBL13219294 0.81 PHLPP2 (0.37) GAAKMT2AMAPTMAPK1TDP1
SCHEMBL18820790 0.81 GBA1 (0.39) PHLPP2GBA1LMNAPTK2
SCHEMBL13201666 0.80 PTPN11 (0.33) PTK2
SCHEMBL58808 0.80 GBA1 (0.45) GBA1POLBNPC1RAB9A
SCHEMBL13911192 0.79 PHLPP2 (0.46) GAAKMT2AMAPTMAPK1TDP1
SCHEMBL22308296 0.79 CRHR1 (0.36) GAAKMT2AMAPTMAPK1TDP1
SCHEMBL13151812 0.79 MAPT (0.37) GAAKMT2AMAPTMAPK1TDP1

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-2695920-A1 Ink, ink cartridge and ink jet recording method Canon Kabushiki Kaisha (JP) 2014-02-12 — — EP disclosed
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