SCHEMBL31334166

SCHEMBL31334166

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

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 1/20 0.49
KDM4E B2RXH2 4/20 0.48
ALDH1A1 P00352 4/20 0.48
DRD2 P14416 1/20 0.48
DRD4 P21917 1/20 0.48
ACHE P22303 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
RECQL P46063 1/20 0.48
TRPV6 Q9H1D0 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 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
SCHEMBL31334479 0.88 DRD2 (0.50) DRD2DRD4ACHEMEN1KMT2A
SCHEMBL7338535 0.85 SMN1; SMN2 (0.55) CHRM4KDM4EALDH1A1ACHESMN1; SMN2
SCHEMBL31333511 0.84 ALDH1A1 (0.50) CHRM4KDM4EALDH1A1ACHESMN1; SMN2
SCHEMBL3779080 0.81 CHRM4 (0.56) CHRM4KDM4EALDH1A1ACHESMN1; SMN2
SCHEMBL7298928 0.81 HTR1D (0.47) CHRM4KDM4EALDH1A1ACHESMN1; SMN2
SCHEMBL23689558 0.81 KMT2A (0.61) CHRM4KDM4EALDH1A1DRD2ACHE
Hydrochloric Acid SCHEMBL3966170 0.81 CHRM4 (0.55) CHRM4KDM4EALDH1A1ACHESMN1; SMN2
SCHEMBL3026317 0.80 ACHE (0.52) CHRM4KDM4EALDH1A1ACHESMN1; SMN2
SCHEMBL31334285 0.80 DRD2 (0.47) CHRM4KDM4EALDH1A1DRD2ACHE
SCHEMBL4717872 0.80 SMN1; SMN2 (0.51) CHRM4KDM4EALDH1A1ACHESMN1; SMN2

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