SCHEMBL7440983

SCHEMBL7440983

CCCc1ccc(C(CCO)N2C(=O)c3ccccc3C2=O)cc1CCC

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TNF P01375 13/20 0.61
PDE4A P27815 8/20 0.43
PDE4B Q07343 8/20 0.43
PDE4C Q08493 8/20 0.43
PDE4D Q08499 8/20 0.43
MEN1 O00255 1/20 0.39
KMT2A Q03164 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
SCHEMBL7446266 0.88 TNF (0.65) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL7448361 0.82 MEN1 (0.63) TNFMEN1KMT2A
SCHEMBL7441945 0.77 TNF (0.74) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL10323080 0.76 TNF (0.62) TNFMEN1KMT2A
SCHEMBL10323079 0.76 TNF (0.62) TNFMEN1KMT2A
SCHEMBL825484 0.76 TNF (1.00) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL7445922 0.74 TNF (0.84) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL7439026 0.73 TNF (0.53) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL8779393 0.72 CYP1A2 (0.37) TNF
SCHEMBL16692506 0.71 TNF (0.50) TNFPDE4APDE4BPDE4CPDE4D

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
US-5703098-A INHIBITORS OF CYTOKINES INCLUDING TUMOR NECROSIS FACTOR CELGENE CORPORATION (US) 1997-12-30 US claimed
EP-0797437-B1 IMMUNOTHERAPEUTIC IMIDES/AMIDES AND THEIR USE FOR REDUCING LEVELS OF TNFalpha CELGENE CORP (US) 2001-04-18 EP disclosed
EP-0942902-A2 NOVEL IMMUNOTHERAPEUTIC IMIDES/AMIDES CELGENE CORPORATION (US) 1999-09-22 EP disclosed
WO-1998024763-A2 IMMUNOTHERAPEUTIC IMIDES/AMIDES AS PDE IV AND TNF INHIBITORS CELGENE CORPORATION (US) 1998-06-11 WO disclosed
US-5703098-A INHIBITORS OF CYTOKINES INCLUDING TUMOR NECROSIS FACTOR CELGENE CORPORATION (US) 1997-12-30 US disclosed
EP-0797437-A1 IMMUNOTHERAPEUTIC IMIDES/AMIDES AND THEIR USE FOR REDUCING LEVELS OF TNF$g(a) CELGENE CORPORATION (US) 1997-10-01 EP disclosed
WO-1996020705-A1 IMMUNOTHERAPEUTIC IMIDES/AMIDES AND THEIR USE FOR REDUCING LEVELS OF TNF$g(a) CELGENE CORPORATION (US) 1996-07-11 WO disclosed