SCHEMBL20568445

SCHEMBL20568445

CCCN1CCN(c2cc(NC(=O)c3ccc(C)c(Oc4ncnc5c4OCCN5)c3)cc(C(F)(F)F)c2)CC1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP4K2 Q12851 5/20 0.60
MAP3K7 O43318 4/20 0.60
BRAF P15056 12/20 0.48
KIT P10721 2/20 0.46
LDLR P01130 1/20 0.46
PCSK9 Q8NBP7 1/20 0.46
CSF1R P07333 2/20 0.45
LYN P07948 1/20 0.45
MAPK14 Q16539 1/20 0.44
MAP3K20 Q9NYL2 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
SCHEMBL20568100 0.95 MAP4K2 (0.59) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20568729 0.93 MAP4K2 (0.51) MAP4K2MAP3K7BRAFKITCSF1R
SCHEMBL20568408 0.93 MAP4K2 (0.69) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20570016 0.91 MAP4K2 (0.56) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20568682 0.91 MAP4K2 (0.60) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20568615 0.89 MAP4K2 (0.59) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20568684 0.87 MAP3K7 (0.50) MAP4K2MAP3K7BRAFMAPK14MAP3K20
SCHEMBL20569395 0.86 MAP4K2 (0.54) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20569030 0.85 DDR2 (0.52) MAP4K2MAP3K7BRAFKITLYN
SCHEMBL20570131 0.85 MAP4K2 (0.59) MAP4K2MAP3K7BRAFKITCSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112601752-A Novel inhibitors of MAP4K1 伊克诺斯科学公司 2021-04-02 CN claimed
EP-3630778-A1 NOVEL INHIBITORS OF MAP4K1 Ichnos Sciences SA (CH) 2020-04-08 EP claimed
WO-2018215668-A1 NOVEL INHIBITORS OF MAP4K1 GLENMARK PHARMACEUTICALS S.A. (CH) 2018-11-29 WO claimed