SCHEMBL20569397

SCHEMBL20569397

CCN1CCN(Cc2cc(NC(=O)c3ccc(Cl)c(Oc4ncnc5c4OCCN5)c3)cc(C(F)(F)F)c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DDR2 Q16832 13/20 0.48
DDR1 Q08345 12/20 0.48
KIT P10721 5/20 0.48
ABL1 P00519 7/20 0.44
MAP3K7 O43318 4/20 0.44
MAP4K2 Q12851 4/20 0.44
MAPK14 Q16539 3/20 0.44
MAP3K20 Q9NYL2 1/20 0.44
FES P07332 1/20 0.44
FER P16591 1/20 0.44
BCR P11274 3/20 0.44
KDR P35968 2/20 0.44
FGFR1 P11362 1/20 0.43
CSF1R P07333 1/20 0.43

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
SCHEMBL20569030 0.93 DDR2 (0.52) DDR2DDR1KITABL1MAP3K7
SCHEMBL20568684 0.91 MAP3K7 (0.50) DDR1MAP3K7MAP4K2MAPK14MAP3K20
SCHEMBL20568102 0.90 MAP3K7 (0.44) MAP3K7MAP4K2MAPK14MAP3K20FES
SCHEMBL20568750 0.89 DDR1 (0.50) DDR2DDR1KITABL1BCR
SCHEMBL20568362 0.89 DDR1 (0.50) DDR2DDR1KITABL1BCR
SCHEMBL20568363 0.89 DDR1 (0.50) DDR2DDR1KITABL1BCR
SCHEMBL20569406 0.88 DDR1 (0.43) DDR2DDR1KITABL1MAP3K7
SCHEMBL20569243 0.87 RET (0.44) MAP3K7MAP4K2MAPK14KDR
SCHEMBL20568477 0.87 MAP3K7 (0.60) ABL1MAP3K7MAP4K2MAPK14MAP3K20
SCHEMBL20568492 0.85 RET (0.45) KITMAP3K7MAP4K2KDRCSF1R

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