SCHEMBL13815258

SCHEMBL13815258

CC(C)(C)C(=O)Oc1ccc2c(c1)Oc1cc(OC(=O)C(C)(C)C)c(CCCCC(=O)NCCCCCCO)cc1C21OC(=O)c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ HTT P42858 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ LMNA P02545 2/20 0.49
▸ USP2 O75604 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ CYP3A4 P08684 1/20 0.42
▸ GSTP1 P09211 1/20 0.42
▸ ITPR3 Q14573 1/20 0.41
▸ FTO Q9C0B1 4/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ SMAD3 P84022 1/20 0.38
▸ PRMT1 Q99873 1/20 0.38
▸ ACE2 Q9BYF1 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL13815246 0.92 MAPT (0.52) MAPTMEN1HTTKMT2ALMNA
SCHEMBL13815257 0.87 MEN1 (0.42) MAPTMEN1HTTKMT2ALMNA
SCHEMBL13815241 0.86 MEN1 (0.52) MAPTMEN1HTTKMT2ALMNA
SCHEMBL13815259 0.84 MEN1 (0.40) MAPTMEN1HTTKMT2ALMNA
SCHEMBL13815255 0.81 FTO (0.54) MAPTMEN1HTTKMT2ALMNA
SCHEMBL13823119 0.81 MAPT (0.46) MAPTMEN1HTTKMT2ALMNA
SCHEMBL6879196 0.78 GSTP1 (0.50) MAPTMEN1HTTKMT2ALMNA
SCHEMBL5058843 0.77 MAPT (0.77) MAPTMEN1HTTKMT2ALMNA
SCHEMBL13815245 0.76 MEN1 (0.42) MAPTMEN1HTTKMT2ALMNA
SCHEMBL18173525 0.74 MAPT (0.71) MAPTMEN1HTTKMT2ALMNA

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
US-7541454-B2 Compounds and methods for fluorescent labeling EPOCH BIOSCIENCES, INC. (US) 2009-06-02 — — US disclosed
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