SCHEMBL12798101

SCHEMBL12798101

CCCCCCCCCC(CCCCCCCCOC(=O)Cc1ccc(Nc2ccc(O)c3c2C(=O)c2ccccc2C3=O)cc1)C(CCCCCCCCC)CCCCCCCCOC(=O)Cc1ccc(Nc2ccc(O)c3c2C(=O)c2ccccc2C3=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ MAPT P10636 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ MAPK1 P28482 2/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ PRKCA P17252 2/20 0.43
▸ ALDH1A1 P00352 3/20 0.36
▸ HSD17B10 Q99714 3/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ P2RY4 P51582 1/20 0.35
▸ CDC25B P30305 1/20 0.34
▸ TSHR P16473 2/20 0.34
▸ MAOA P21397 1/20 0.34
▸ CYP1A2 P05177 2/20 0.34

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
SCHEMBL12798105 0.88 MEN1 (0.40) LMNAMEN1MAPTKMT2AMAPK1
SCHEMBL13884740 0.88 NPC1 (0.55) LMNAMEN1MAPTKMT2AMAPK1
SCHEMBL13884840 0.83 MEN1 (0.49) LMNAMEN1MAPTKMT2AMAPK1
SCHEMBL12798093 0.83 MEN1 (0.43) LMNAMEN1MAPTKMT2AMAPK1
SCHEMBL13884735 0.83 NPC1 (0.53) LMNAMEN1MAPTKMT2AMAPK1
SCHEMBL12798099 0.82 MEN1 (0.67) LMNAMEN1MAPTKMT2AMAPK1
SCHEMBL13884737 0.82 MAPT (0.59) LMNAMEN1MAPTKMT2AMAPK1
SCHEMBL10933156 0.82 NPC1 (0.57) LMNAMEN1MAPTKMT2AMAPK1
SCHEMBL12798092 0.80 KMT2A (0.67) LMNAMEN1MAPTKMT2AMAPK1
SCHEMBL13884784 0.80 MEN1 (0.43) LMNAMEN1MAPTKMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7901496-B2 Phase change inks XEROX CORPORATION (US) 2011-03-08 — — US disclosed
US-7901496-B2 Phase change inks XEROX CORPORATION (US) 2011-03-08 — — US disclosed
US-7683192-B2 Colorant compounds XEROX CORPORATION (US) 2010-03-23 — — US disclosed
US-7683192-B2 Colorant compounds XEROX CORPORATION (US) 2010-03-23 — — US disclosed
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