SCHEMBL30786401

SCHEMBL30786401

O=C(O)CCCN(CCCC(=O)O)CCC(=O)Nc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ICMT O60725 3/20 0.71
▸ ALB P02768 3/20 0.71
▸ L3MBTL1 Q9Y468 2/20 0.58
▸ HDAC1 Q13547 7/20 0.56
▸ MEN1 O00255 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ MAPT P10636 2/20 0.54
▸ HDAC4 P56524 6/20 0.53
▸ HDAC7 Q8WUI4 6/20 0.53
▸ HDAC11 Q96DB2 6/20 0.53
▸ HDAC8 Q9BY41 6/20 0.53
▸ HDAC6 Q9UBN7 6/20 0.53
▸ HDAC9 Q9UKV0 6/20 0.53
▸ HDAC5 Q9UQL6 6/20 0.53
▸ HDAC3 O15379 5/20 0.53
▸ HDAC2 Q92769 5/20 0.53
▸ HDAC10 Q969S8 5/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ BRD4 O60885 1/20 0.53
▸ NCOR1 O75376 1/20 0.53

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
SCHEMBL30895871 0.83 ICMT (1.00) ICMTALBHDAC1MAPTHDAC4
SCHEMBL3806017 0.83 MEN1 (0.73) L3MBTL1HDAC1MEN1KMT2AMAPT
SCHEMBL1060805 0.83 HDAC4 (0.73) L3MBTL1HDAC1MEN1KMT2AMAPT
SCHEMBL22439796 0.82 ICMT (0.71) ICMTALBHDAC1HDAC4HDAC7
SCHEMBL22439785 0.82 ICMT (0.76) ICMTALBHDAC1HDAC4HDAC7
SCHEMBL1064861 0.81 HDAC4 (0.77) L3MBTL1HDAC1MEN1KMT2AMAPT
SCHEMBL312344 0.81 HDAC4 (0.77) L3MBTL1HDAC1MEN1KMT2AMAPT
SCHEMBL22439787 0.80 ICMT (0.65) ICMTALBHDAC1HDAC4HDAC7
SCHEMBL22439788 0.79 HDAC1 (0.68) ICMTALBHDAC1MEN1KMT2A
SCHEMBL94252 0.79 L3MBTL1 (0.89) L3MBTL1HDAC1MEN1KMT2AMAPT

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
CN-117487375-A Red dye derivative and application thereof in high-temperature direct-injection red disperse dye ink 沈阳化工研究院有限公司 2024-02-02 — — CN disclosed
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