SCHEMBL24975689

SCHEMBL24975689

COc1cc2ncc(C)n2nc1C1CC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 13/20 0.36
▸ LRRK2 Q5S007 1/20 0.34
▸ TRPC6 Q9Y210 2/20 0.34
▸ MAPK7 Q13164 1/20 0.32
▸ FYN P06241 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ PDGFRB P09619 1/20 0.32
▸ PDGFRA P16234 1/20 0.32

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
SCHEMBL24975688 0.84 PDE10A (0.34) PDE10ALRRK2TRPC6FYNPDGFRB
SCHEMBL31739611 0.77 DYRK1A (0.37) FYN
SCHEMBL31000264 0.75 — —
SCHEMBL27332713 0.75 NRAS (0.36) TRPC6FYN
SCHEMBL31639175 0.75 NRAS (0.36) TRPC6FYN
SCHEMBL31639341 0.73 PDE10A (0.34) PDE10ALRRK2TRPC6KDM4EALDH1A1
SCHEMBL29682761 0.73 FLT3 (0.42) FYNPDGFRBPDGFRA
SCHEMBL24542495 0.73 FLT3 (0.42) FYNPDGFRBPDGFRA
SCHEMBL31000261 0.72 IGF1R (0.38) —
SCHEMBL31000231 0.72 NRAS (0.34) TRPC6FYN

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
WO-2023009833-A9 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2023-11-23 — — WO disclosed
WO-2023009833-A1 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2023-02-02 — — WO disclosed
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