SCHEMBL20568615

SCHEMBL20568615

Cc1ccc(C(=O)Nc2cc(N3CCN(C(C)C)CC3)cc(C(F)(F)F)c2)cc1Oc1ncnc2c1OCCN2

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP4K2 Q12851 4/20 0.59
MAP3K7 O43318 3/20 0.59
BRAF P15056 10/20 0.52
KIT P10721 2/20 0.47
LDLR P01130 1/20 0.47
PCSK9 Q8NBP7 1/20 0.47
CSF1R P07333 2/20 0.45
LYN P07948 1/20 0.45
KDR P35968 2/20 0.44
TEK Q02763 1/20 0.42
ABL1 P00519 1/20 0.42

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
SCHEMBL20569081 0.93 MAP4K2 (0.50) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20568408 0.92 MAP4K2 (0.69) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20568682 0.92 MAP4K2 (0.60) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20568100 0.91 MAP4K2 (0.59) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20568445 0.89 MAP4K2 (0.60) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20570016 0.88 MAP4K2 (0.56) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20568115 0.86 MAP4K2 (0.54) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20568117 0.86 MAP4K2 (0.54) MAP4K2MAP3K7BRAFKITLDLR
SCHEMBL20568744 0.85 MAP4K2 (0.67) MAP4K2MAP3K7BRAFKITLDLR
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