SCHEMBL7446266

SCHEMBL7446266

CCc1ccc(C(CCO)N2C(=O)c3ccccc3C2=O)cc1CC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 12/20 0.65
PDE4A P27815 8/20 0.45
PDE4B Q07343 8/20 0.45
PDE4C Q08493 8/20 0.45
PDE4D Q08499 8/20 0.45
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
GLA P06280 1/20 0.40
POLB P06746 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40
NFKB1 P19838 1/20 0.40
APEX1 P27695 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL7440983 0.88 TNF (0.61) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL7439026 0.84 TNF (0.53) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL7436433 0.80 MEN1 (0.67) TNFMEN1KMT2AKDM4EALDH1A1
SCHEMBL7441945 0.80 TNF (0.74) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL10323079 0.79 TNF (0.62) TNFMEN1KMT2AKDM4EALDH1A1
SCHEMBL10323080 0.79 TNF (0.62) TNFMEN1KMT2AKDM4EALDH1A1
SCHEMBL825484 0.79 TNF (1.00) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL7445922 0.77 TNF (0.84) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL16692506 0.71 TNF (0.50) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL8779431 0.71 CYP1A2 (0.40) TNFMEN1KMT2AKDM4EALDH1A1

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