SCHEMBL31333384

SCHEMBL31333384

CC(C)(C)OC(=O)NC1CCN(C2CCN(c3ccc([N+](=O)[O-])cc3F)CC2(F)F)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 1/20 0.45
▸ MAPT P10636 3/20 0.42
▸ THRB P10828 1/20 0.42
▸ ALDH1A1 P00352 5/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ LMNA P02545 2/20 0.41
▸ SLC6A9 P48067 2/20 0.39
▸ SLC6A5 Q9Y345 2/20 0.39
▸ POLB P06746 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ CKS1B P61024 1/20 0.37
▸ SKP1 P63208 1/20 0.37
▸ SKP2 Q13309 1/20 0.37
▸ TDP1 Q9NUW8 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
SCHEMBL13419542 0.89 DRD2 (0.54) DRD2MAPTTHRBALDH1A1KMT2A
SCHEMBL30915181 0.89 DRD2 (0.54) DRD2MAPTTHRBALDH1A1KMT2A
SCHEMBL31334551 0.87 MAPT (0.48) MAPTTHRBALDH1A1KMT2ALMNA
SCHEMBL31334075 0.87 CKS1B (0.39) DRD2MAPTALDH1A1LMNACKS1B
SCHEMBL4287745 0.84 ALDH1A1 (0.51) DRD2MAPTTHRBALDH1A1KMT2A
SCHEMBL5232224 0.84 ALDH1A1 (0.51) DRD2MAPTTHRBALDH1A1KMT2A
SCHEMBL4287750 0.84 ALDH1A1 (0.51) DRD2MAPTTHRBALDH1A1KMT2A
SCHEMBL31333941 0.82 DRD2 (0.46) DRD2MAPTTHRBALDH1A1KMT2A
SCHEMBL31334849 0.82 DRD2 (0.54) DRD2MAPTTHRBALDH1A1KMT2A
SCHEMBL31333664 0.82 DRD2 (0.51) DRD2MAPTTHRBALDH1A1KMT2A

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
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