SCHEMBL31334200

SCHEMBL31334200

OC1CCC(Nc2ncc(F)c(-c3cccc(-c4ccccc4)c3)n2)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 5/20 0.61
ADORA2A P29274 3/20 0.59
ADORA2B P29275 1/20 0.59
GSK3A P49840 3/20 0.47
GSK3B P49841 2/20 0.47
MAPK10 P53779 5/20 0.46
MAPK8 P45983 5/20 0.46
MAPK9 P45984 4/20 0.46
JUN P05412 1/20 0.46
MAPK14 Q16539 2/20 0.45
CSNK2A2 P19784 1/20 0.43
CSNK2B P67870 1/20 0.43
RIPK2 O43353 1/20 0.43
AXL P30530 1/20 0.43
FLT3 P36888 1/20 0.43
TYRO3 Q06418 1/20 0.43
MERTK Q12866 1/20 0.43
GAS6 Q14393 1/20 0.43
IRAK1 P51617 1/20 0.42
CCNB2 O95067 1/20 0.41

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
SCHEMBL31333320 1.00 ADORA1 (0.61) ADORA1ADORA2AADORA2BGSK3AGSK3B
SCHEMBL31333856 0.88 CDK9 (0.50) ADORA1ADORA2AADORA2BMAPK10MAPK8
SCHEMBL31334046 0.88 CDK9 (0.50) ADORA1ADORA2AADORA2BMAPK10MAPK8
SCHEMBL31334890 0.87 ADORA1 (0.47) ADORA1ADORA2AADORA2BCSNK2A2CSNK2B
SCHEMBL31333367 0.87 ADORA1 (0.47) ADORA1ADORA2AADORA2BCSNK2A2CSNK2B
SCHEMBL31334719 0.87 ADORA1 (0.47) ADORA1ADORA2AADORA2BCSNK2A2CSNK2B
SCHEMBL31334614 0.86 HDAC1 (0.48) ADORA1ADORA2AADORA2BMAPK8CCNB2
SCHEMBL31333452 0.85 MAPK8 (0.50) ADORA1ADORA2AADORA2BMAPK10MAPK8
SCHEMBL31333834 0.85 ADORA1 (0.46) ADORA1ADORA2AADORA2BMAPK8MAPK9
SCHEMBL31334031 0.83 MAPK8 (0.49) ADORA1ADORA2AADORA2BGSK3AGSK3B

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