SCHEMBL4379764

SCHEMBL4379764

CC(=O)N1CCN(c2ccc(Nc3nc(N[C@H](C)CO)c4ccn(S(=O)(=O)c5ccc(C)cc5)c4n3)cc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 13/20 0.55
FLT3 P36888 1/20 0.51
ALK Q9UM73 1/20 0.43
FGFR4 P22455 2/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
JAK3 P52333 1/20 0.41
CDK4 P11802 1/20 0.41
CCND1 P24385 1/20 0.41
CCND2 P30279 1/20 0.41
CCND3 P30281 1/20 0.41

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
SCHEMBL1017621 1.00 SYK (0.55) SYKFLT3ALKFGFR4KDM4E
SCHEMBL1018900 0.88 FGFR4 (0.42) SYKFLT3FGFR4JAK3CDK4
SCHEMBL13666948 0.84 FLT3 (0.56) SYKFLT3ALKFGFR4KDM4E
SCHEMBL13387229 0.82 FLT3 (0.49) SYKFLT3ALKFGFR4JAK3
SCHEMBL1041462 0.81 SYK (0.51) SYKFLT3ALKFGFR4JAK3
SCHEMBL1072338 0.81 FLT3 (0.48) SYKFLT3ALKFGFR4CDK4
SCHEMBL12082785 0.81 FLT3 (0.48) SYKFLT3ALKFGFR4CDK4
SCHEMBL1017778 0.81 SYK (0.54) SYKFLT3ALKFGFR4
SCHEMBL3280387 0.80 SYK (0.58) SYKFLT3ALKFGFR4CDK4
SCHEMBL3279674 0.80 FLT3 (0.48) SYKFLT3ALKFGFR4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2271631-B1 INHIBITORS OF PROTEIN KINASES PORTOLA PHARM INC (US) 2018-07-04 EP disclosed
US-9139581-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2015-09-22 US disclosed
US-20130029944-A1 INHIBITORS OF PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2013-01-31 US disclosed
US-8258144-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2012-09-04 US disclosed
US-20090298823-A1 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2009-12-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130029944-A1 INHIBITORS OF PROTEIN KINASES SYK, BTK, JAK2 SYK 1/4885FLT3 18/4885ALK 180/4885
US-20090298823-A1 Inhibitors of protein kinases SYK, BTK, JAK2 SYK 1/4885FLT3 18/4885ALK 180/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.