SCHEMBL30400509

SCHEMBL30400509

CN1CCN(C(=O)c2cnc3[nH]cc(-c4ccc5c(c4)C4(CCNCC4)CC5=O)c3c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAP3K11 Q16584 7/20 0.51
▸ TNIK Q9UKE5 7/20 0.48
▸ ACACB O00763 1/20 0.42
▸ ACACA Q13085 1/20 0.42
▸ IGF1R P08069 2/20 0.41
▸ MAP4K1 Q92918 3/20 0.38
▸ IL2 P60568 2/20 0.38

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
SCHEMBL26174982 1.00 MAP3K11 (0.51) MAP3K11TNIKACACBACACAIGF1R
SCHEMBL30399129 0.94 MAP3K11 (0.53) MAP3K11TNIKACACBACACAIGF1R
SCHEMBL26174983 0.94 MAP3K11 (0.53) MAP3K11TNIKACACBACACAIGF1R
SCHEMBL26174943 0.86 EGLN1 (0.42) MAP3K11TNIKMAP4K1IL2
SCHEMBL30399705 0.86 EGLN1 (0.42) MAP3K11TNIKMAP4K1IL2
SCHEMBL26175021 0.86 MAP3K11 (0.36) MAP3K11TNIKMAP4K1IL2
SCHEMBL30400516 0.86 MAP3K11 (0.36) MAP3K11TNIKMAP4K1IL2
SCHEMBL30399704 0.85 DYRK1A (0.39) MAP3K11TNIKACACBACACAMAP4K1
SCHEMBL26175063 0.85 DYRK1A (0.39) MAP3K11TNIKACACBACACAMAP4K1
SCHEMBL30400006 0.85 MAP3K11 (0.49) MAP3K11TNIKACACBIGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4415817-A1 1H-PYRROLO[2,3-B]PYRIDINES AS DYRK1A INHIBITORS BioSplice Therapeutics, Inc. (US) 2024-08-21 — — EP claimed
WO-2023064349-A1 1H-PYRROLO[2,3-B]PYRIDINES AS DYRK1A INHIBITORS BIOSPLICE THERAPEUTICS, INC. (US) 2023-04-20 — — WO claimed
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