SCHEMBL5581659

SCHEMBL5581659

CCOC(=O)C(CC)Oc1cccc(-c2cc(Cl)cc(-c3cccc(CNC(=O)OC(C)(C)C)c3)n2)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ ACACA Q13085 1/20 0.39
▸ BRD4 O60885 3/20 0.39
▸ CREBBP Q92793 1/20 0.39
▸ DYRK1A Q13627 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ CTSL P07711 1/20 0.37
▸ GLS O94925 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ SYK P43405 1/20 0.36

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
SCHEMBL5581572 0.81 ACACB (0.45) ACACBCYP1A2CYP3A4CYP2C9ACACA
SCHEMBL5580714 0.76 ACACB (0.47) ACACBCYP1A2CYP3A4CYP2C9ACACA
SCHEMBL3847043 0.73 BRD4 (0.47) ACACBCYP1A2CYP3A4CYP2C9ACACA
SCHEMBL30504293 0.71 HDAC1 (0.56) BRD4CREBBPGLS
SCHEMBL6285318 0.70 CTSL (0.56) BRD4TSHRCTSLGLSRXFP1
SCHEMBL4402738 0.70 BRD4 (0.49) ACACBCYP1A2CYP3A4CYP2C9ACACA
SCHEMBL31755970 0.70 BRD4 (0.49) ACACBCYP1A2CYP3A4CYP2C9ACACA
SCHEMBL4327276 0.70 GLS (0.44) BRD4CREBBPMAPTTSHRSMN1; SMN2
SCHEMBL16410204 0.70 CFD (0.47) ACACBCYP1A2CYP3A4CYP2C9ACACA
SCHEMBL17764496 0.70 CFD (0.55) ACACBCYP1A2CYP3A4CYP2C9ACACA

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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