SCHEMBL6972777

SCHEMBL6972777

Cc1ccc(NC(=O)Oc2ccnc(N3CCCC3)c2)cc1NC(=O)c1cccc(CN2CCN(C)CC2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.55
KIT P10721 11/20 0.48
CSF1R P07333 7/20 0.48
DDR1 Q08345 2/20 0.47
ABL1 P00519 5/20 0.47
BRAF P15056 5/20 0.47
BCR P11274 4/20 0.47
MAPK14 Q16539 3/20 0.47
EGFR P00533 3/20 0.47
ABL2 P42684 2/20 0.47
PDGFRA P16234 2/20 0.47
PLK4 O00444 1/20 0.47
DDX3X O00571 1/20 0.47
GAK O14976 1/20 0.47
SLC22A2 O15244 1/20 0.47
MAPK13 O15264 1/20 0.47
CA12 O43570 1/20 0.47
SLC22A3 O75751 1/20 0.47
ABCB11 O95342 1/20 0.47
CA1 P00915 1/20 0.47

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
SCHEMBL6976381 0.99 HPGDS (0.54) HPGDSKITCSF1RDDR1ABL1
SCHEMBL6968978 0.94 MAPK14 (0.54) HPGDSBRAFMAPK14RAF1
SCHEMBL6978092 0.92 MAPK14 (0.54) HPGDSBRAFMAPK14RAF1
SCHEMBL6968114 0.92 HPGDS (0.50) HPGDSKITCSF1RDDR1ABL1
SCHEMBL6973537 0.90 HPGDS (0.62) HPGDSKITCSF1RDDR1ABL1
SCHEMBL6979840 0.89 HPGDS (0.61) HPGDSKITCSF1RDDR1ABL1
SCHEMBL6974176 0.84 MAPK14 (0.54) KITCSF1RDDR1ABL1BRAF
SCHEMBL6968243 0.83 MAPK14 (0.61) HPGDSBRAFMAPK14RAF1
SCHEMBL6980722 0.82 MAPK14 (0.65) HPGDSBRAFMAPK14RAF1
SCHEMBL31721214 0.82 HPGDS (0.65) HPGDSKITCSF1RDDR1BRAF

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 1 patent. 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 claimed