SCHEMBL29320024

SCHEMBL29320024

C/C(=N\C(P)P)c1ncc(C(=O)Nc2cc(C(F)(F)F)c(Cl)cn2)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 4/20 0.51
BCR P11274 4/20 0.51
DYRK1A Q13627 3/20 0.51
BRAF P15056 2/20 0.51
EPHB6 O15197 1/20 0.51
RAF1 P04049 1/20 0.51
PDGFRB P09619 1/20 0.51
EPHA1 P21709 1/20 0.51
EPHA2 P29317 1/20 0.51
WEE1 P30291 1/20 0.51
TGFBR2 P37173 1/20 0.51
ABL2 P42684 1/20 0.51
FRK P42685 1/20 0.51
MAP2K4 P45985 1/20 0.51
CLK1 P49759 1/20 0.51
LIMK1 P53667 1/20 0.51
EPHB4 P54760 1/20 0.51
DDR1 Q08345 1/20 0.51
MAP3K1 Q13233 1/20 0.51
MYLK Q15746 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
SCHEMBL10183989 0.87 ABL1 (0.52) ABL1BCRDYRK1ABRAFEPHB6
SCHEMBL20573372 0.87 ABL1 (0.52) ABL1BCRDYRK1ABRAFEPHB6
SCHEMBL21919544 0.86 DYRK1A (0.49) ABL1BCRDYRK1ABRAFEPHB6
SCHEMBL21836258 0.85 MAPK14 (0.47) ABL1BCRDYRK1ABRAFEPHB6
SCHEMBL30664416 0.85 MAPK14 (0.47) ABL1BCRDYRK1ABRAFEPHB6
SCHEMBL21836257 0.85 MAPK14 (0.47) ABL1BCRDYRK1ABRAFEPHB6
SCHEMBL10183996 0.85 ABL1 (0.55) ABL1BCRDYRK1ABRAFEPHB6
SCHEMBL30664387 0.85 ABL1 (0.55) ABL1BCRDYRK1ABRAFEPHB6
SCHEMBL21836237 0.84 DYRK1A (0.49) ABL1BCRDYRK1ABRAFEPHB6
SCHEMBL21836240 0.84 DYRK1A (0.49) ABL1BCRDYRK1ABRAFEPHB6

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
EP-3632441-B1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DAY ONE BIOPHARMACEUTICALS INC (US) 2024-07-17 EP disclosed