SCHEMBL6693845

SCHEMBL6693845

COc1ccc(C(CC(=O)O)N2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.79

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TNF P01375 11/20 0.79
KMT2A Q03164 2/20 0.67
ATM Q13315 1/20 0.67
PDE4A P27815 6/20 0.64
PDE4B Q07343 6/20 0.64
PDE4C Q08493 6/20 0.64
PDE4D Q08499 6/20 0.64
ALDH1A1 P00352 1/20 0.51
HSD17B10 Q99714 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MEN1 O00255 1/20 0.49

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
SCHEMBL6693277 0.88 TNF (0.77) TNFKMT2AATMPDE4APDE4B
SCHEMBL6688763 0.88 TNF (1.00) TNFKMT2AATMPDE4APDE4B
SCHEMBL28722625 0.87 TNF (0.72) TNFKMT2AATMPDE4APDE4B
SCHEMBL6688750 0.87 PDE4A (0.68) TNFKMT2AATMPDE4APDE4B
SCHEMBL6691607 0.86 TNF (0.70) TNFKMT2AATMPDE4APDE4B
SCHEMBL6693354 0.86 KMT2A (0.63) TNFKMT2AATMPDE4APDE4B
SCHEMBL6689045 0.85 ALDH1A1 (0.65) TNFKMT2APDE4APDE4BPDE4C
SCHEMBL6692623 0.85 TNF (0.72) TNFKMT2AATMPDE4APDE4B
SCHEMBL6690149 0.85 TNF (0.59) TNFKMT2AATMPDE4APDE4B
SCHEMBL6691297 0.83 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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1477486-A2 Imides as inhibitors of TNF alpha CELGENE CORPORATION (US) 2004-11-17 EP claimed
US-5605914-A INHIBITORS OF TUMOR NECROSIS FACTOR CELGENE CORPORATION (US) 1997-02-25 US claimed
EP-1477486-A2 Imides as inhibitors of TNF alpha CELGENE CORPORATION (US) 2004-11-17 EP disclosed
EP-0706521-B1 IMIDES AS TNF ALPHA INHIBITORS CELGENE CORP (US) 2002-10-02 EP disclosed
US-6200987-B1 ADMINISTERING AS TUMOR NECROSIS FACTOR INHIBITORS; CACHEXIA, ENDOTOXIN SHOCK; RETROVIRUS VIRICIDES CELGENE CORPORATION 2001-03-13 US disclosed
US-6075041-A TUMOR NECROSIS FACTOR CELGENE CORPORATION (US) 2000-06-13 US disclosed
EP-1004580-A2 Imides as inhibitors of TNF alpha CELGENE CORPORATION (US) 2000-05-31 EP disclosed
EP-1004581-A2 Process for the preparation of thalidomide CELGENE CORPORATION (US) 2000-05-31 EP disclosed
EP-1004572-A2 Amines as inhibitors of TNF alpha CELGENE CORPORATION (US) 2000-05-31 EP disclosed
US-5877200-A Cyclic amides CELGENE CORPORATION (US) 1999-03-02 US disclosed
US-5698579-A INHIBITOR OF TUMOR NECROSIS FACTOR CELGENE CORPORATION (US) 1997-12-16 US disclosed
US-5605914-A INHIBITORS OF TUMOR NECROSIS FACTOR CELGENE CORPORATION (US) 1997-02-25 US disclosed
EP-0706521-A1 NOVEL IMIDES CELGENE CORPORATION (US) 1996-04-17 EP disclosed
US-5463063-A Preparation of thalidomide; inhibitor of tumor necrosis factor CELGENE CORPORATION (US) 1995-10-31 US disclosed
WO-1995001348-A2 IMIDES AS INHIBITORS OF TNP ALPHA CELGENE CORPORATION (US) 1995-01-12 WO disclosed