SCHEMBL6677237

SCHEMBL6677237

COc1ccc(C(=O)Nc2cc(NC(=O)c3ccc(C#N)cc3)ccc2Cl)cc1OC

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.65
MAPT P10636 2/20 0.61
PDE4D Q08499 1/20 0.59
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
ALDH1A1 P00352 4/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
POLB P06746 3/20 0.54
HPGD P15428 1/20 0.54
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
TP53 P04637 1/20 0.53
NQO2 P16083 1/20 0.52
CASP3 P42574 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
KDM4E B2RXH2 1/20 0.52
SMO Q99835 3/20 0.52
LMNA P02545 1/20 0.51

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
SCHEMBL6676839 0.91 MAPK14 (0.70) MAPK14MAPTPDE4DMEN1KMT2A
SCHEMBL6780345 0.88 MAPK14 (0.64) MAPK14MAPTMEN1KMT2AALDH1A1
SCHEMBL6682415 0.87 MEN1 (0.60) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL14375741 0.86 MAPK14 (0.70) MAPK14MAPTPDE4DMEN1KMT2A
SCHEMBL6676301 0.86 MAPK14 (0.77) MAPK14MAPTPDE4DMEN1KMT2A
SCHEMBL6678076 0.81 KMT2A (0.52) MAPK14MAPTMEN1KMT2AALDH1A1
SCHEMBL6681043 0.79 MAPK14 (0.66) MAPK14MAPTPDE4DMEN1KMT2A
SCHEMBL6678101 0.79 MAPK14 (1.00) MAPK14MAPTPDE4DALDH1A1SMN1; SMN2
SCHEMBL6781935 0.77 MAPK14 (0.68) MAPK14MAPTPDE4DMEN1KMT2A
SCHEMBL3781363 0.77 KDM4E (0.75) MAPTMEN1KMT2AALDH1A1SMN1; SMN2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077930-B1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ASTRAZENECA AB (SE) 2004-11-10 EP claimed
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 claimed
EP-1077930-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES AstraZeneca AB (SE) 2001-02-28 EP claimed
WO-1999059960-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ASTRAZENECA AB (SE) 1999-11-25 WO claimed
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