SCHEMBL31334650

SCHEMBL31334650

N[C@H]1CCC[C@H](Nc2ncc(Cl)c(-c3cccc(-c4ccccc4)c3)n2)C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 3/20 0.52
PIM1 P11309 4/20 0.45
AXL P30530 1/20 0.43
TYRO3 Q06418 1/20 0.43
MERTK Q12866 1/20 0.43
ADORA2A P29274 1/20 0.42
CDK7 P50613 4/20 0.42
CDK2 P24941 3/20 0.42
CDK9 P50750 2/20 0.42
CDC7 O00311 1/20 0.42
DAPK3 O43293 1/20 0.42
JAK2 O60674 1/20 0.42
ROCK2 O75116 1/20 0.42
PRKD3 O94806 1/20 0.42
MAP4K4 O95819 1/20 0.42
PAK4 O96013 1/20 0.42
PRKACA P17612 1/20 0.42
FLT3 P36888 1/20 0.42
CSNK1A1 P48729 1/20 0.42
CDK8 P49336 1/20 0.42

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
SCHEMBL31334197 1.00 ADORA1 (0.52) ADORA1PIM1AXLTYRO3MERTK
SCHEMBL31333867 1.00 ADORA1 (0.52) ADORA1PIM1AXLTYRO3MERTK
SCHEMBL31334729 0.86 CCNT1 (0.53) ADORA1AXLTYRO3MERTKADORA2A
SCHEMBL31334905 0.86 CCNT1 (0.53) ADORA1AXLTYRO3MERTKADORA2A
SCHEMBL31334093 0.86 CCNT1 (0.53) ADORA1AXLTYRO3MERTKADORA2A
SCHEMBL31334355 0.85 MAPK3 (0.52) ADORA1ADORA2ACDK7CDK9CCNT1
SCHEMBL31334779 0.85 MAPK3 (0.56) ADORA1ADORA2ACDK7CDK9CCNT1
SCHEMBL31333846 0.85 MAPK3 (0.56) ADORA1ADORA2ACDK7CDK9CCNT1
SCHEMBL31334595 0.85 MAPK3 (0.56) ADORA1ADORA2ACDK7CDK9CCNT1
SCHEMBL18069763 0.85 PIM1 (0.49) ADORA1PIM1CDK7CDK2CDK9

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