SCHEMBL5064019

SCHEMBL5064019

COc1ccccc1-c1n[nH]c2ncc(-c3cccc(C(C(=O)N(C)C)N(C)C)c3)cc12

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.45
MAP4K1 Q92918 2/20 0.45
FGFR2 P21802 1/20 0.39
NEK1 Q96PY6 2/20 0.38
KIT P10721 3/20 0.37
AAK1 Q2M2I8 2/20 0.37
LRRK2 Q5S007 1/20 0.37
CTSA P10619 1/20 0.37
DYRK1A Q13627 1/20 0.37
DYRK1B Q9Y463 1/20 0.37
FYN P06241 1/20 0.36
AXL P30530 1/20 0.36
RIPK1 Q13546 1/20 0.36
CYP3A4 P08684 1/20 0.36
IGF1R P08069 1/20 0.35

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
SCHEMBL11968591 0.93 ABL1 (0.42) ABL1MAP4K1FGFR2NEK1KIT
SCHEMBL5063976 0.92 ABL1 (0.46) ABL1MAP4K1FGFR2NEK1KIT
SCHEMBL5064649 0.91 ABL1 (0.45) ABL1MAP4K1FGFR2NEK1KIT
SCHEMBL5063980 0.90 MAP4K1 (0.46) ABL1MAP4K1FGFR2NEK1KIT
SCHEMBL5064022 0.90 ABL1 (0.45) ABL1MAP4K1FGFR2NEK1KIT
SCHEMBL11968590 0.90 FYN (0.40) ABL1MAP4K1FGFR2NEK1KIT
SCHEMBL5067367 0.90 ABL1 (0.44) ABL1MAP4K1FGFR2NEK1KIT
SCHEMBL11968603 0.84 CDK8 (0.48) ABL1MAP4K1FGFR2NEK1KIT
SCHEMBL11968602 0.84 CDK8 (0.48) ABL1MAP4K1FGFR2NEK1KIT
SCHEMBL5067418 0.84 ABL1 (0.51) ABL1MAP4K1FGFR2KITAAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242280-B2 morpholin-4-yl-{3-[3-(1H-pyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridin-5-yl-phenyl}-methanone; FMS-like tyrosine kinase 3 (FLT3), is implicated in cancers, including leukemia, such as acute myeloid leukemia (AML), acute lymphoblastic leukemia (ALL), and myelodysplasia SGX PHARMACEUTICALS, INC. (US) 2012-08-14 US disclosed
US-8242280-B2 morpholin-4-yl-{3-[3-(1H-pyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridin-5-yl-phenyl}-methanone; FMS-like tyrosine kinase 3 (FLT3), is implicated in cancers, including leukemia, such as acute myeloid leukemia (AML), acute lymphoblastic leukemia (ALL), and myelodysplasia SGX PHARMACEUTICALS, INC. (US) 2012-08-14 US disclosed
US-8242280-B2 morpholin-4-yl-{3-[3-(1H-pyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridin-5-yl-phenyl}-methanone; FMS-like tyrosine kinase 3 (FLT3), is implicated in cancers, including leukemia, such as acute myeloid leukemia (AML), acute lymphoblastic leukemia (ALL), and myelodysplasia SGX PHARMACEUTICALS, INC. (US) 2012-08-14 US disclosed
US-20080261921-A1 FUSED RING HETEROCYCLE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-10-23 US disclosed
US-20080261921-A1 FUSED RING HETEROCYCLE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-10-23 US disclosed
US-20080261921-A1 FUSED RING HETEROCYCLE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-10-23 US disclosed
WO-2008124848-A1 FUSED RING HETEROCYCLE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-10-16 WO 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 (1 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-20080261921-A1 FUSED RING HETEROCYCLE KINASE MODULATORS MAP3K20, MAP3K19, MAP4K2 ABL1 110/4885MAP4K1 17/4885FGFR2 738/4885

“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.