SCHEMBL11968554

SCHEMBL11968554

COc1ccccc1-c1n[nH]c2ncc(-c3cccc(C(O)c4nccn4C)c3)cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
FGB P02675 1/20 0.41
ALOX15 P16050 1/20 0.41
TNNI3 P19429 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP1 P29466 1/20 0.41
BRCA1 P38398 1/20 0.41
TNNT2 P45379 1/20 0.41
CASP7 P55210 1/20 0.41
TNNC1 P63316 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
HSD17B10 Q99714 1/20 0.41
FFAR1 O14842 1/20 0.41
FGFR2 P21802 1/20 0.39
CD274 Q9NZQ7 1/20 0.38
MAPT P10636 1/20 0.36
AAK1 Q2M2I8 1/20 0.36

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
SCHEMBL11968506 0.85 ABL1 (0.50) AAK1ABL1MAP4K1KIT
SCHEMBL5064613 0.84 FGFR2 (0.41) FGFR2AAK1ABL1MAP4K1LRRK2
SCHEMBL11968603 0.84 CDK8 (0.48) FGFR2AAK1ABL1MAP4K1LRRK2
SCHEMBL11968602 0.84 CDK8 (0.48) FGFR2AAK1ABL1MAP4K1LRRK2
SCHEMBL5064592 0.83 FGFR2 (0.42) KMT2AMEN1ALOX15MAPK1HSD17B10
SCHEMBL3488611 0.83 KIT (0.41) FGFR2AAK1ABL1MAP4K1LRRK2
SCHEMBL4364255 0.83 FGFR2 (0.46) KMT2AMEN1ALOX15MAPK1HSD17B10
SCHEMBL4366169 0.83 CTSA (0.42) FGFR2AAK1ABL1MAP4K1LRRK2
SCHEMBL11968553 0.81 FGFR2 (0.39) FGFR2AAK1ABL1MAP4K1LRRK2
SCHEMBL11968593 0.81 FGFR2 (0.41) FGFR2AAK1ABL1MAP4K1LRRK2

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
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
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 KDM4E 1048/4885KMT2A 1079/4885MEN1 3329/4885

“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.