SCHEMBL6682097

SCHEMBL6682097

COc1ccc(C(=O)Nc2cc(NC(=O)c3cccc(N(C)C)c3)c(F)cc2Cl)cc1OC

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.73
PDE4D Q08499 1/20 0.56
CYP1A2 P05177 2/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2C19 P33261 1/20 0.55
EGFR P00533 2/20 0.54
MAPT P10636 2/20 0.53
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
HPGD P15428 1/20 0.50
POLB P06746 2/20 0.49
NPC1 O15118 1/20 0.48
TP53 P04637 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ABCB1 P08183 1/20 0.48

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
SCHEMBL6678101 0.84 MAPK14 (1.00) MAPK14PDE4DCYP1A2CYP3A4EGFR
SCHEMBL6677756 0.84 MAPK14 (1.00) MAPK14CYP1A2CYP3A4CYP2C19EGFR
SCHEMBL6681443 0.79 MAPT (0.57) MAPK14CYP1A2CYP3A4MAPTALDH1A1
SCHEMBL6782336 0.77 MAPK14 (1.00) MAPK14CYP1A2CYP3A4MAPTALDH1A1
SCHEMBL6781511 0.77 MAPK14 (1.00) MAPK14CYP1A2CYP3A4MAPTALDH1A1
SCHEMBL6679437 0.76 MAPK14 (1.00) MAPK14CYP1A2CYP3A4EGFRMAPT
SCHEMBL7755234 0.75 MAPK14 (0.92) MAPK14CYP1A2CYP3A4EGFRMAPT
SCHEMBL27527556 0.74 MAPK14 (0.75) MAPK14CYP1A2CYP3A4EGFRMAPT
SCHEMBL2980389 0.74 MAPK14 (0.86) MAPK14CYP1A2CYP3A4MAPTALDH1A1
SCHEMBL6678591 0.73 MAPT (0.50) MAPK14MAPTALDH1A1KDM4EHPGD

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
CN-1188389-C Benzamide derivatives for the treatment of diseases mediated by cytokines ASTRA ZENECA LTD (SE) 2005-02-09 CN disclosed
EP-1077930-B1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ASTRAZENECA AB (SE) 2004-11-10 EP disclosed
US-6465455-B1 TUMOUR NECROSIS FACTOR AND INTERLEUKIN FAMILY INHIBITORS; INHIBITION OF ENZYME P38 KINASE; INFLAMMATION, IMMUNO-REGULATION, ALLERGIES ASTRAZENECA AB (SE) 2002-10-15 US disclosed
EP-1077930-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES AstraZeneca AB (SE) 2001-02-28 EP disclosed
WO-1999059960-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ASTRAZENECA AB (SE) 1999-11-25 WO disclosed