SCHEMBL31333569

SCHEMBL31333569

CC(C)(C)OC(=O)CC1(O)CCN(CC2CCN(c3ccc4[nH]c(=O)oc4c3)CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.38
HTR1A P08908 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37
GRIN3A Q8TCU5 1/20 0.37

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
SCHEMBL31334672 0.87 GRIN1 (0.40) ENPP2HTR1ASLC6A2SLC6A3GRIN2D
SCHEMBL31333413 0.84 ENPP2 (0.47) ENPP2HTR1ASLC6A2SLC6A3
SCHEMBL31334685 0.82 TGFBR1 (0.46) ENPP2HTR1ASLC6A2SLC6A3
SCHEMBL31334470 0.81 DRD2 (0.46) ENPP2HTR1ASLC6A2SLC6A3GRIN2D
SCHEMBL31334328 0.80 CRBN (0.40)
SCHEMBL31333744 0.76 SIRT6 (0.44)
SCHEMBL30258401 0.76 PDE3B (0.43) HTR1ASLC6A2SLC6A3
SCHEMBL31334925 0.76 GRIN1 (0.43) ENPP2HTR1ASLC6A2SLC6A3GRIN2D
SCHEMBL31334601 0.73 CKS1B (0.42) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL24794739 0.73 ENPP2 (0.45) ENPP2

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