SCHEMBL13295446

SCHEMBL13295446

CCCCCCCCN(CCCCCCCC)c1ccc2c(-c3ccccc3C(=O)O)c3ccc(=[N+](CCCCCCCC)CCCCCCCC)cc-3oc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.47
▸ FPR2 P25090 4/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ BLM P54132 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ THRB P10828 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ POLB P06746 2/20 0.44
▸ USP2 O75604 2/20 0.44
▸ PPARG P37231 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ NCOR2 Q9Y618 1/20 0.44
▸ TLR7 Q9NYK1 1/20 0.42
▸ P2RY6 Q15077 1/20 0.41
▸ FTO Q9C0B1 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ CA12 O43570 2/20 0.39

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
SCHEMBL13295428 1.00 TGM2 (0.47) TGM2FPR2MEN1BLMKMT2A
SCHEMBL13295448 0.93 MEN1 (0.48) TGM2FPR2MEN1BLMKMT2A
SCHEMBL13295432 0.93 MEN1 (0.48) TGM2FPR2MEN1BLMKMT2A
SCHEMBL12259397 0.90 TGM2 (0.43) TGM2FPR2MEN1BLMKMT2A
SCHEMBL14156628 0.88 MEN1 (0.54) TGM2FPR2MEN1BLMKMT2A
SCHEMBL17171812 0.87 TGM2 (0.45) TGM2FPR2MEN1BLMKMT2A
SCHEMBL12259392 0.87 MEN1 (0.59) TGM2FPR2MEN1BLMKMT2A
Hydrochloric Acid SCHEMBL19127347 0.84 MEN1 (0.53) TGM2FPR2MEN1BLMKMT2A
Stearic Acid SCHEMBL10583270 0.84 TGM2 (0.55) TGM2FPR2MEN1BLMKMT2A
SCHEMBL29593395 0.83 MEN1 (0.61) TGM2FPR2MEN1BLMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7732625-B2 Colorant compounds XEROX CORPORATION (US) 2010-06-08 — — US disclosed
US-7311767-B2 Forming a salt of a liquid phase change ink carrier of stearyl stearamide, an amine substituted Xanthene, acridine, anthracene or thioxanthene chromogen, and a metal salt capable of forming a compound with two chromogens XEROX CORPORATION (US) 2007-12-25 — — US disclosed
US-7301025-B2 N-(2-(2-(alkyl[carbamoyl, carbonyloxy or ureido]alkyl)pyridinium)-5-(carboxy or sulfo)phenyl-8-((2-(N-alkyl[carbamoyl or ureido]alkyl)pyridinyl) xanthene ligands complexed with a metal or metal-containing moiety; magenta dye with improved heat resistance; hot melts or phase change inks XEROX CORPORATION (US) 2007-11-27 — — US disclosed
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