SCHEMBL31334997

SCHEMBL31334997

O=C1CCC(Nc2ccc(N3CCC(N4CCN(CCC(=O)N5CCC(Nc6ncc(Cl)c(-c7cccc(-c8ccccc8)c7)n6)CC5)CC4)CC3)cc2)C(=O)N1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 15/20 0.43
CCNC P24863 1/20 0.40
CDK8 P49336 1/20 0.40
IRAK1 P51617 1/20 0.40
NTRK3 Q16288 1/20 0.40
HASPIN Q8TF76 1/20 0.40
CRBN Q96SW2 1/20 0.40
CDK19 Q9BWU1 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.40
IRAK3 Q9Y616 1/20 0.40
ALK Q9UM73 1/20 0.40
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
JAK3 P52333 1/20 0.38
JUN P05412 2/20 0.38
CDK2 P24941 2/20 0.38
MAPK8 P45983 2/20 0.38
MAPK9 P45984 2/20 0.38
MAPK10 P53779 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
SCHEMBL31333897 0.92 MAPK1 (0.45) MAPK1JUNCDK2MAPK8MAPK9
SCHEMBL30919940 0.86 BTK (0.40) CRBNALKJAK2JAK1JAK3
SCHEMBL31333673 0.82 MAPK1 (0.48) MAPK1JUNCDK2MAPK8MAPK9
SCHEMBL31334754 0.81 MAPK1 (0.45) MAPK1JUNCDK2MAPK8MAPK9
SCHEMBL31334848 0.81 MAPK1 (0.40) MAPK1CRBNJAK2JAK1JAK3
SCHEMBL31335016 0.79 MAPK1 (0.49) MAPK1
SCHEMBL31334220 0.79 IKZF1 (0.50) MAPK1
SCHEMBL31334453 0.77 MAPK1 (0.41) MAPK1CRBN
SCHEMBL30919835 0.75 DDB1 (0.58) CRBN
SCHEMBL27260491 0.74 ALK (0.33) CCNCCDK8IRAK1NTRK3HASPIN

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-4709720-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN Larkspur Biosciences, Inc. (US) 2026-03-18 EP disclosed
WO-2024233846-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN LARKSPUR BIOSCIENCES, INC. (US) 2024-11-14 WO disclosed