SCHEMBL31334084

SCHEMBL31334084

COC(=O)c1cccc(-c2nc(N[C@H]3CC[C@H](NC(=O)OC(C)(C)C)CC3)ncc2F)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.46
BTK Q06187 3/20 0.44
CKS1B P61024 1/20 0.44
SKP1 P63208 1/20 0.44
SKP2 Q13309 1/20 0.44
MCHR1 Q99705 4/20 0.41
ADRA2A P08913 2/20 0.41
ADRA1A P35348 2/20 0.41
HRH1 P35367 2/20 0.41
HTR2B P41595 2/20 0.41
DYRK2 Q92630 4/20 0.40
SYK P43405 1/20 0.39
LIPG Q9Y5X9 1/20 0.38
KDM4D Q6B0I6 1/20 0.38
MERTK Q12866 1/20 0.38
ADORA1 P30542 1/20 0.38
CDK8 P49336 1/20 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
SCHEMBL31333816 0.92 MAPK1 (0.47) MAPK1BTKCKS1BSKP1SKP2
SCHEMBL31333311 0.90 MAPK1 (0.46) MAPK1MCHR1ADRA2AADRA1AHRH1
SCHEMBL31333206 0.89 CKS1B (0.51) MAPK1BTKCKS1BSKP1SKP2
SCHEMBL31333835 0.88 MCHR1 (0.44) MAPK1MCHR1ADRA2AADRA1AHRH1
SCHEMBL31333445 0.87 MAPK1 (0.47) MAPK1BTKCKS1BSKP1SKP2
SCHEMBL31333542 0.85 MERTK (0.46) MAPK1CKS1BSKP1SKP2DYRK2
SCHEMBL31333638 0.83 MAPK1 (0.45) MAPK1BTKCKS1BSKP1SKP2
SCHEMBL31334563 0.83 CKS1B (0.47) MAPK1CKS1BSKP1SKP2DYRK2
SCHEMBL31334086 0.81 MAPK1 (0.47) MAPK1CKS1BSKP1SKP2MCHR1
SCHEMBL31334873 0.81 CDK2 (0.47) MAPK1BTKDYRK2

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