SCHEMBL28023585

SCHEMBL28023585

CCN(CCN(C(C)C)C(C)C)c1cc(N(C)C(=O)Nc2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)ncn1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LCK P06239 4/20 0.64
BRAF P15056 12/20 0.52
CSF1R P07333 3/20 0.51
KIT P10721 2/20 0.51
KDR P35968 3/20 0.46
RAF1 P04049 1/20 0.46
PDGFRB P09619 1/20 0.46
PDGFRA P16234 1/20 0.46
BMX P51813 1/20 0.45
INSR P06213 1/20 0.45
LYN P07948 1/20 0.45
HCK P08631 1/20 0.45
SRC P12931 1/20 0.45
BTK Q06187 1/20 0.45
TEK Q02763 1/20 0.44

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
SCHEMBL374496 0.87 LCK (0.67) LCKBRAFCSF1RKITKDR
SCHEMBL374728 0.83 LCK (0.65) LCKBRAFCSF1RKITKDR
SCHEMBL374545 0.82 LCK (0.68) LCKBRAFCSF1RKITKDR
SCHEMBL374503 0.82 LCK (0.67) LCKBRAFCSF1RKITKDR
SCHEMBL374492 0.81 LCK (0.70) LCKBRAFCSF1RKITKDR
SCHEMBL379539 0.81 LCK (0.59) LCKBRAFCSF1RKITKDR
SCHEMBL374499 0.79 LCK (0.76) LCKBRAFCSF1RKITKDR
SCHEMBL373967 0.79 LCK (0.64) LCKBRAFCSF1RKITKDR
SCHEMBL374341 0.79 LCK (0.67) LCKBRAFCSF1RKITKDR
SCHEMBL374410 0.78 LCK (0.66) LCKBRAFCSF1RKITKDR

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-103121972-B As the pyrimidine urea derivatives of kinase inhibitor NOVARTIS AG (CH) 2015-07-29 CN disclosed