SCHEMBL20568652

SCHEMBL20568652

CCN1CCN(Cc2ccc(NC(=O)c3cc(Oc4ncnc5c4OCCN5)ccc3F)cc2C(F)(F)F)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K7 O43318 8/20 0.51
MAP4K2 Q12851 8/20 0.51
MAPK14 Q16539 7/20 0.51
MKNK2 Q9HBH9 7/20 0.51
HCK P08631 6/20 0.51
MKNK1 Q9BUB5 5/20 0.51
FES P07332 4/20 0.51
FER P16591 4/20 0.51
ABL1 P00519 3/20 0.51
BCR P11274 3/20 0.51
MAP3K20 Q9NYL2 3/20 0.51
STK25 O00506 1/20 0.51
CIT O14578 1/20 0.51
MAP2K7 O14733 1/20 0.51
IKBKB O14920 1/20 0.51
AURKA O14965 1/20 0.51
GAK O14976 1/20 0.51
CHUK O15111 1/20 0.51
MUSK O15146 1/20 0.51
MAPK13 O15264 1/20 0.51

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
SCHEMBL20569006 0.93 MAP3K7 (0.51) MAP3K7MAP4K2MAPK14MKNK2HCK
SCHEMBL20570128 0.90 MAP3K7 (0.57) MAP3K7MAP4K2MAPK14MKNK2HCK
SCHEMBL20569489 0.89 ABL1 (0.65) MAP3K7MAP4K2MAPK14MKNK2HCK
SCHEMBL20569149 0.89 KDR (0.56) MAP3K7MAP4K2MAPK14MKNK2HCK
SCHEMBL20568307 0.89 MAP3K7 (0.61) MAP3K7MAP4K2MAPK14HCKFES
SCHEMBL20568285 0.89 MAP3K7 (0.62) MAP3K7MAP4K2MAPK14MKNK2HCK
SCHEMBL20568508 0.87 MAP3K7 (0.53) MAP3K7MAP4K2MAPK14MKNK2HCK
SCHEMBL20569338 0.87 MAP3K7 (0.54) MAP3K7MAP4K2MAPK14MKNK2HCK
SCHEMBL20569298 0.87 MAP3K7 (0.53) MAP3K7MAP4K2MAPK14MKNK2HCK
SCHEMBL20568763 0.86 MAP3K7 (0.62) MAP3K7MAP4K2MAPK14HCKFES

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