SCHEMBL25934074

SCHEMBL25934074

c1cc(CNc2cncc(-c3ccc4cn[nH]c4c3)c2)cc(-c2cccc(CNc3ncc(-c4ccc5cn[nH]c5c4)cn3)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CLK4 Q9HAZ1 6/20 0.50
▸ DYRK1A Q13627 6/20 0.50
▸ CLK1 P49759 5/20 0.50
▸ CDK2 P24941 3/20 0.50
▸ FGFR1 P11362 5/20 0.47
▸ FGFR2 P21802 1/20 0.47
▸ FGFR3 P22607 1/20 0.47
▸ CLK2 P49760 5/20 0.47
▸ DYRK1B Q9Y463 3/20 0.47
▸ MAP4K4 O95819 3/20 0.45
▸ AURKB Q96GD4 3/20 0.45
▸ CDK8 P49336 3/20 0.45
▸ PRKD3 O94806 2/20 0.45
▸ NTRK1 P04629 2/20 0.45
▸ CSNK1A1 P48729 2/20 0.45
▸ NTRK3 Q16288 2/20 0.45
▸ NTRK2 Q16620 2/20 0.45
▸ TAOK1 Q7L7X3 2/20 0.45
▸ PDGFRB P09619 2/20 0.45
▸ PDGFRA P16234 2/20 0.45

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
SCHEMBL25933932 0.92 DYRK1A (0.50) CLK4DYRK1ACLK1CDK2CLK2
SCHEMBL24137530 0.86 FGFR1 (0.56) CLK4DYRK1ACLK1CDK2FGFR1
SCHEMBL24137529 0.82 FGFR1 (0.60) CLK4DYRK1ACLK1CDK2FGFR1
SCHEMBL24137563 0.77 CCNC (0.61) CLK4DYRK1ACLK1CDK2FGFR1
SCHEMBL25934164 0.74 FYN (0.45) DYRK1ACLK1MAP4K4NTRK1FYN
SCHEMBL24137467 0.74 KCNH2 (0.49) CLK4DYRK1ACDK2CLK2AURKB
SCHEMBL24137561 0.73 ROCK2 (0.63) CLK4DYRK1ACLK1CDK2FGFR1
SCHEMBL25938463 0.71 BRAF (0.45) DYRK1ACLK1FGFR1NTRK1FYN
SCHEMBL24137567 0.70 DYRK1A (0.56) CLK4DYRK1ACLK1CDK2FGFR1
SCHEMBL22191838 0.69 CCNT1 (0.48) CLK4DYRK1ACLK1CDK2CLK2

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
US-20230234935-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI 2023-07-27 — — 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 (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-20230234935-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE PACSIN2, MAP3K20, PHKG1 CLK4 176/4885DYRK1A 495/4885CLK1 82/4885

“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.

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