SCHEMBL31334285

SCHEMBL31334285

CN(C(=O)OC(C)(C)C)[C@H]1CC[C@H](N2CCN(Cc3ccccc3)CC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.47
HTR2A P28223 2/20 0.47
HTR2C P28335 2/20 0.47
HTR2B P41595 2/20 0.47
SIGMAR1 Q99720 2/20 0.47
KCNH2 Q12809 1/20 0.47
KDM4E B2RXH2 4/20 0.47
ALDH1A1 P00352 4/20 0.47
ACHE P22303 3/20 0.47
RECQL P46063 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CHRM4 P08173 1/20 0.46
BCHE P06276 1/20 0.45

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
SCHEMBL12731682 0.94 KDM4E (0.45) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL12731242 0.94 KDM4E (0.45) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL12731241 0.94 KDM4E (0.45) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL803672 0.89 SIGMAR1 (0.59) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL21026882 0.89 KMT2A (0.49) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL31334937 0.85 DRD2 (0.54) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL31701660 0.83 SMN1; SMN2 (0.48) HTR2AHTR2CHTR2BSIGMAR1SMN1; SMN2
SCHEMBL3815654 0.82 SIGMAR1 (0.51) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL31333511 0.82 ALDH1A1 (0.50) KDM4EALDH1A1ACHERECQLSMN1; SMN2
SCHEMBL7507555 0.82 SIGMAR1 (0.51) DRD2HTR2AHTR2CHTR2BSIGMAR1

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