SCHEMBL23707047

SCHEMBL23707047

CC(C)c1cn(CC(C)c2cn(CC(C)c3cn(C)c4ncccc34)c3nc(C(F)(F)F)ccc23)c2ncccc12

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAT2A P31153 5/20 0.36
▸ HTR6 P50406 5/20 0.34
▸ DYRK1A Q13627 2/20 0.33
▸ HTR3A P46098 2/20 0.32
▸ USP1 O94782 2/20 0.31
▸ PDE10A Q9Y233 1/20 0.31
▸ PRKCB P05771 1/20 0.31
▸ GSK3B P49841 1/20 0.31
▸ PRMT5 O14744 1/20 0.31
▸ WDR77 Q9BQA1 1/20 0.31
▸ TLR9 Q9NR96 1/20 0.31
▸ TLR8 Q9NR97 1/20 0.31
▸ TLR7 Q9NYK1 1/20 0.31

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
SCHEMBL820570 0.75 DYRK1A (0.47) DYRK1AGSK3BPRMT5WDR77TLR9
SCHEMBL18993230 0.71 DYRK1A (0.49) HTR6DYRK1APRKCBGSK3BTLR9
SCHEMBL20697023 0.67 CNR2 (0.53) PRKCBGSK3B
SCHEMBL20697252 0.66 GSK3B (0.53) PRKCBGSK3B
SCHEMBL24117380 0.65 PDPK1 (0.36) DYRK1AGSK3BTLR9TLR8TLR7
SCHEMBL15077818 0.65 DYRK1A (0.44) DYRK1AGSK3BPRMT5WDR77TLR9
SCHEMBL12874831 0.64 PDE4A (0.41) DYRK1AGSK3B
SCHEMBL21227429 0.63 HTR6 (0.49) HTR6
SCHEMBL21245970 0.63 HTR6 (0.42) HTR6GSK3B
SCHEMBL23937871 0.63 DYRK1A (0.46) HTR6DYRK1APRKCBGSK3B

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-11078201-B2 Substituted isoindolin-1-ones and 2,3-dihydro-1H-pyrrol[3,4-c]pyridin-1-ones as HPK1 antagonists Nimbus Saturn, Inc. (US) 2021-08-03 — — 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 (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-11078201-B2 Substituted isoindolin-1-ones and 2,3-dihydro-1H-pyrrol[3,4-c]pyridin-1-ones as HPK1 antagonists HIPK1, PDXK, IP6K1 MAT2A 2154/4885HTR6 423/4885DYRK1A 488/4885

“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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