SCHEMBL31334685

SCHEMBL31334685

CC(C)(C)OC(=O)N1CCC(CN2CCN(c3ccc4[nH]c(=O)oc4c3)CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 3/20 0.46
ENPP2 Q13822 3/20 0.45
HTR1A P08908 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
GPR119 Q8TDV5 7/20 0.44
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
CNR1 P21554 1/20 0.42
KCNH2 Q12809 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
SCHEMBL31333413 0.96 ENPP2 (0.47) TGFBR1ENPP2HTR1ASLC6A2SLC6A3
SCHEMBL24794177 0.87 ALDH1A1 (0.50) HTR1ASLC6A2SLC6A3GPR119DDB1
SCHEMBL31334672 0.85 GRIN1 (0.40) ENPP2HTR1ASLC6A2SLC6A3KCNH2
SCHEMBL31334470 0.83 DRD2 (0.46) ENPP2HTR1ASLC6A2SLC6A3
SCHEMBL31333569 0.82 ENPP2 (0.38) ENPP2HTR1ASLC6A2SLC6A3
SCHEMBL29709766 0.82 ENPP2 (0.45) ENPP2
SCHEMBL24794739 0.82 ENPP2 (0.45) ENPP2
SCHEMBL31701665 0.80 GPR119 (0.44) TGFBR1GPR119DDB1CRBNCNR1
SCHEMBL24793643 0.79 ATXN2 (0.50) ENPP2
SCHEMBL24793630 0.79 ATXN2 (0.48) 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