SCHEMBL27699790

SCHEMBL27699790

COc1ccc(C(=O)Nc2ccc(C)c(C(=O)Nc3cccnc3)c2)cc1OC

nearest known ligand 0.79

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.79
BRAF P15056 14/20 0.77
GAA P10253 1/20 0.72
CSF1R P07333 3/20 0.64
ALDH1A1 P00352 1/20 0.64
KIT P10721 1/20 0.62
KDR P35968 1/20 0.62
MAPK14 Q16539 1/20 0.62

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
SCHEMBL3941843 0.94 BRAF (0.77) LMNABRAFGAACSF1RKIT
SCHEMBL12978269 0.89 LMNA (1.00) LMNAGAAALDH1A1
SCHEMBL3934629 0.88 LMNA (0.77) LMNABRAFGAACSF1RALDH1A1
SCHEMBL3937838 0.88 BRAF (0.76) LMNABRAFGAACSF1RKIT
SCHEMBL3936918 0.87 BRAF (1.00) BRAFCSF1R
SCHEMBL3937724 0.87 CSF1R (0.83) BRAFCSF1RKITKDRMAPK14
SCHEMBL13947089 0.86 LMNA (0.81) LMNABRAFGAACSF1RALDH1A1
SCHEMBL3942646 0.85 BRAF (0.83) BRAFCSF1RALDH1A1
SCHEMBL3933426 0.85 BRAF (0.84) BRAFCSF1RALDH1A1
SCHEMBL3932583 0.85 CSF1R (0.79) LMNABRAFGAACSF1R

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
CN-101128454-A Pyridine carboxamide derivatives for use as anticancer agents ASTRAZENECA AB (SE) 2008-02-20 CN disclosed