SCHEMBL7437121

SCHEMBL7437121

COc1ccc(C(CCOCc2cccnc2)N2C(=O)c3ccccc3C2=O)cc1OC

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TNF P01375 9/20 0.60
PDE4A P27815 13/20 0.53
PDE4B Q07343 13/20 0.53
PDE4C Q08493 13/20 0.53
PDE4D Q08499 13/20 0.53

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
SCHEMBL7430065 0.89 TNF (0.54) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL7432875 0.86 KMT2A (0.53) TNF
SCHEMBL6691026 0.83 TNF (0.67) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL7433895 0.82 PDE4A (0.67) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL7434917 0.81 TNF (0.72) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL7432606 0.80 TNF (0.77) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL8779401 0.78 HSD17B10 (0.41) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL7437416 0.77 PDE4A (0.70) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL8777035 0.77 TNF (0.58) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL825484 0.76 TNF (1.00) 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 5 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