SCHEMBL6684464

SCHEMBL6684464

O=[C]c1cccc(C(=O)Nc2c[c]ccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
KCNK3 O14649 4/20 0.44
KCNK9 Q9NPC2 3/20 0.44
RXFP1 Q9HBX9 2/20 0.43
KCNH2 Q12809 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
PKM P14618 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
THRB P10828 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.40

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
SCHEMBL27946687 0.80 KMT2A (0.64) MEN1KMT2AKCNK3KCNK9HDAC1
SCHEMBL26985932 0.80 KCNK3 (0.64) MEN1KMT2AKCNK3KCNK9RXFP1
SCHEMBL750529 0.79 KCNK3 (0.59) MEN1KMT2AKCNK3KCNK9SIRT1
SCHEMBL9799718 0.77 PTGS1 (0.60) MEN1KMT2AKCNK3KCNK9RXFP1
SCHEMBL1680201 0.77 KCNK3 (0.50) MEN1KMT2AKCNK3KCNK9RXFP1
SCHEMBL7165213 0.77 RAB9A (0.70) MEN1KMT2AKCNK3KCNK9RXFP1
SCHEMBL4909972 0.77 LMNA (0.70) MEN1KMT2AKCNK3KCNK9RXFP1
SCHEMBL7379264 0.76 KCNK3 (0.71) MEN1KMT2AKCNK3KCNK9SIRT1
SCHEMBL26696846 0.76 IRAK1 (0.53) MEN1KMT2AKCNK3KCNK9RXFP1
SCHEMBL27966080 0.76 SNCA (0.57) MEN1KMT2AKCNK3KCNK9SIRT1

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
EP-0924239-B1 Durable hydrophilic coating for textiles GEN ELECTRIC (US) 2004-11-24 EP claimed
EP-0038885-A1 Microcellular heterocyclic polymer structures EXXON RESEARCH AND ENGINEERING COMPANY (US) 1981-11-04 EP disclosed