SCHEMBL6979731

SCHEMBL6979731

Cc1ccc(NC(=O)c2ccc3ncccc3c2)cc1NC(=O)c1cccc(OCc2ccccn2)c1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.69
SMO Q99835 11/20 0.69
BRAF P15056 2/20 0.64
CSF1R P07333 1/20 0.61
HSF1 Q00613 1/20 0.59
PABPC1 P11940 1/20 0.51
NPC1 O15118 1/20 0.51
POLB P06746 1/20 0.51
RAB9A P51151 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
SCHEMBL6979946 0.93 MAPK14 (0.74) MAPK14SMOBRAFCSF1RHSF1
SCHEMBL6971304 0.90 BRAF (0.65) MAPK14SMOBRAFCSF1RHSF1
SCHEMBL7827201 0.89 MAPK14 (0.65) MAPK14SMOBRAFCSF1RHSF1
SCHEMBL6979265 0.84 BRAF (0.77) MAPK14SMOBRAFCSF1RHSF1
SCHEMBL5897251 0.84 BRAF (0.76) MAPK14SMOBRAFCSF1RHSF1
SCHEMBL6977566 0.83 BRAF (0.62) MAPK14SMOBRAFCSF1RHSF1
SCHEMBL6972795 0.82 BRAF (0.61) MAPK14SMOBRAFCSF1RHSF1
SCHEMBL6975716 0.81 BRAF (0.72) MAPK14SMOBRAFCSF1RHSF1
SCHEMBL6974172 0.81 BRAF (0.60) MAPK14SMOBRAFCSF1RHSF1
SCHEMBL5897487 0.80 CSF1R (0.81) MAPK14SMOBRAFCSF1RHSF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1115707-B1 BENZAMIDE DERIVATIVES AND THER USE AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2003-11-12 EP disclosed
US-6455520-B1 TUMOR NECROSIS FACTOR AND INTERLEUKIN INHIBITORS; ANTIINFLAMMATORY AGENTS, ANTIALLERGENS; BONE DISORDERS ASTRA ZENECA AB (SE) 2002-09-24 US disclosed
EP-1115707-A1 BENZAMIDE DERIVATIVES AND THER USE AS CYTOKINE INHIBITORS AstraZeneca AB (SE) 2001-07-18 EP disclosed
WO-2000018738-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2000-04-06 WO disclosed