SCHEMBL2969812

SCHEMBL2969812

COc1cc(C2CCCC2)ccc1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.58
PDE4B Q07343 11/20 0.54
PDE4A P27815 4/20 0.54
PDE4C Q08493 4/20 0.54
PDE4D Q08499 4/20 0.54
ALDH1A1 P00352 2/20 0.53
QDPR P09417 2/20 0.48
KMO O15229 1/20 0.46
CFB P00751 1/20 0.45
KDM4E B2RXH2 1/20 0.45
HPGD P15428 1/20 0.45
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43

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
SCHEMBL28896136 0.98 ACMSD (0.59) ACMSDPDE4BPDE4APDE4CPDE4D
SCHEMBL25861565 0.94 ALDH1A1 (0.56) ACMSDPDE4BPDE4APDE4CPDE4D
SCHEMBL29196219 0.86 PDE4B (0.50) ACMSDPDE4BPDE4APDE4CPDE4D
SCHEMBL11724514 0.86 PDE4B (0.50) ACMSDPDE4BPDE4APDE4CPDE4D
SCHEMBL27592891 0.86 ACMSD (0.62) ACMSDPDE4BPDE4APDE4CPDE4D
SCHEMBL10638574 0.84 PDE4B (0.48) ACMSDPDE4BPDE4APDE4CPDE4D
SCHEMBL11480718 0.82 PDE4B (0.47) ACMSDPDE4BPDE4APDE4CPDE4D
SCHEMBL10435909 0.82 PDE4A (0.60) ACMSDPDE4BPDE4APDE4CPDE4D
SCHEMBL38660129 0.81 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL30456585 0.81 IKBKE (0.50) ACMSDPDE4BPDE4APDE4CPDE4D

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101402562-B Novel benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO LTD 2013-07-31 CN disclosed
US-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed
CN-101054345-B Novel bensophenone derivatives or salts thereof TOYAMA CHEMICAL CO LTD 2010-06-02 CN disclosed
CN-1602291-B Novel benzophenone derivative or salt thereof TOYAMA CHEMICAL CO LTD 2010-05-12 CN disclosed
CN-101402562-A Novel benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO LTD (JP) 2009-04-08 CN disclosed
CN-101054345-A Novel bensophenone derivatives or salts thereof TOYAMA CHEMICAL CO LTD (JP) 2007-10-17 CN disclosed
CN-1602291-A Novel benzophenone derivative or salt thereof TOYAMA CHEMICAL CO LTD (JP) 2005-03-30 CN disclosed