SCHEMBL5067418

SCHEMBL5067418

COc1ccccc1-c1n[nH]c2ncc(-c3cncc(C(O)C(=O)N(C)C)c3)cc12

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.51
MAP4K1 Q92918 2/20 0.43
CTSA P10619 1/20 0.38
FGFR2 P21802 1/20 0.37
LRRK2 Q5S007 1/20 0.37
CLK2 P49760 1/20 0.36
CLK3 P49761 1/20 0.36
DYRK1A Q13627 1/20 0.36
CAMKK2 Q96RR4 1/20 0.35
AAK1 Q2M2I8 2/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
KIT P10721 4/20 0.34
NTRK1 P04629 2/20 0.34
PIK3CA P42336 2/20 0.34
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL5064649 0.91 ABL1 (0.45) ABL1MAP4K1CTSAFGFR2LRRK2
SCHEMBL11968543 0.85 ABL1 (0.72) ABL1MAP4K1DYRK1ACAMKK2AAK1
SCHEMBL4374487 0.85 ABL1 (0.72) ABL1MAP4K1DYRK1ACAMKK2AAK1
SCHEMBL5063976 0.85 ABL1 (0.46) ABL1MAP4K1CTSAFGFR2LRRK2
SCHEMBL5060932 0.85 ABL1 (0.72) ABL1MAP4K1DYRK1ACAMKK2AAK1
SCHEMBL2600637 0.84 ABL1 (0.41) ABL1MAP4K1CTSAFGFR2LRRK2
SCHEMBL5064019 0.84 ABL1 (0.45) ABL1MAP4K1CTSAFGFR2LRRK2
SCHEMBL12343063 0.83 ABL1 (0.73) ABL1MAP4K1CTSALRRK2AAK1
SCHEMBL5064022 0.83 ABL1 (0.45) ABL1MAP4K1CTSAFGFR2LRRK2
SCHEMBL5063980 0.83 MAP4K1 (0.46) ABL1MAP4K1CTSAFGFR2LRRK2

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 8 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
CN-101679436-A Fused ring heterocycle kinase modulators SGX PHARMACEUTICALS INC 2010-03-24 CN 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 17/4885CTSA 3641/4885

“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.