SCHEMBL5581572

SCHEMBL5581572

CC(C)(C)OC(=O)NCc1cccc(-c2cc(Cl)cc(-c3cccc(O)c3)n2)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 2/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ ACACA Q13085 1/20 0.45
▸ BRD4 O60885 3/20 0.44
▸ CREBBP Q92793 1/20 0.44
▸ GAA P10253 1/20 0.42
▸ GLS O94925 3/20 0.42
▸ NQO2 P16083 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ DYRK1A Q13627 1/20 0.41
▸ CTSL P07711 1/20 0.40
▸ NAMPT P43490 2/20 0.40
▸ KDM4A O75164 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39

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
SCHEMBL2572109 0.86 HDAC1 (0.52) BRD4CREBBPGAAGLSNQO2
SCHEMBL5580714 0.84 ACACB (0.47) ACACBCYP1A2CYP3A4CYP2C9ACACA
SCHEMBL30151702 0.81 GLS (0.52) CYP1A2CYP3A4BRD4CREBBPGAA
SCHEMBL1111369 0.81 GLS (0.52) CYP1A2CYP3A4BRD4CREBBPGAA
SCHEMBL5581659 0.81 ACACB (0.39) ACACBCYP1A2CYP3A4CYP2C9ACACA
SCHEMBL3847043 0.80 BRD4 (0.47) ACACBCYP1A2CYP3A4CYP2C9ACACA
SCHEMBL30504293 0.79 HDAC1 (0.56) BRD4CREBBPGLSHDAC1NAMPT
SCHEMBL2568359 0.78 HDAC1 (0.56) BRD4CREBBPGLSNQO2HDAC1
SCHEMBL2570147 0.78 HDAC1 (0.62) CYP3A4CYP2C9BRD4CREBBPGAA
SCHEMBL6285318 0.78 CTSL (0.56) BRD4GAAGLSCTSLKDM4A

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-20070148164-A1 Neonatal Fc receptor (FcRn)-binding polypeptide variants, dimeric Fc binding proteins and methods related thereto BIOGEN IDEC MA INC. (US) 2007-06-28 — — US disclosed
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