SCHEMBL13884840

SCHEMBL13884840

CCCCCCC(CCCCCCCCCCCC(=O)OCc1ccc(-c2ccc(Nc3ccc(O)c4c3C(=O)c3ccccc3C4=O)cc2)cc1)C(CCCCCC)CCCCCCCCCCCC(=O)OCc1ccc(-c2ccc(Nc3ccc(O)c4c3C(=O)c3ccccc3C4=O)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ PRKCA P17252 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ EP300 Q09472 1/20 0.36
▸ CCKBR P32239 1/20 0.35
▸ TRPV1 Q8NER1 5/20 0.35
▸ ELANE P08246 2/20 0.35
▸ POLM Q9NP87 1/20 0.35
▸ POLK Q9UBT6 1/20 0.35
▸ POLL Q9UGP5 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
SCHEMBL13884855 0.90 MEN1 (0.39) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL13884740 0.89 NPC1 (0.55) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL13884830 0.88 MEN1 (0.48) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL13884841 0.87 NPC1 (0.52) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL12798101 0.83 LMNA (0.52) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL13884831 0.83 MEN1 (0.63) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL13884784 0.82 MEN1 (0.43) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL13884829 0.81 MAPT (0.61) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL13893503 0.80 MEN1 (0.60) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL13884843 0.80 SIRT2 (0.40) MEN1KMT2ANPC1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524979-B2 Methods of making colorant compounds XEROX CORPORATION (US) 2009-04-28 — — US disclosed
US-7524979-B2 Methods of making colorant compounds XEROX CORPORATION (US) 2009-04-28 — — US disclosed
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