SCHEMBL31334600

SCHEMBL31334600

CC(C)(C)OC(=O)NCC1CCN(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.52
ALDH1A1 P00352 4/20 0.52
LMNA P02545 2/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
CKS1B P61024 1/20 0.46
SKP1 P63208 1/20 0.46
SKP2 Q13309 1/20 0.46
DRD2 P14416 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
NAMPT P43490 1/20 0.42
POLB P06746 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
ACACB O00763 1/20 0.41
ACACA Q13085 1/20 0.41

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
SCHEMBL5652480 0.94 MAPT (0.58) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL30738841 0.86 MAPT (0.54) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL31333982 0.86 SIRT6 (0.46) MAPTALDH1A1MEN1KMT2ACKS1B
SCHEMBL31333813 0.86 ALDH1A1 (0.44) MAPTALDH1A1LMNAKMT2ACKS1B
SCHEMBL31333510 0.86 CKS1B (0.48) CKS1BSKP1SKP2DRD2NAMPT
SCHEMBL30198676 0.80 CKS1B (0.54) MAPTCKS1BSKP1SKP2DRD2
SCHEMBL29106557 0.80 ALDH1A1 (0.55) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL12916519 0.80 GPR119 (0.57) MEN1KMT2ACKS1BSKP1SKP2
SCHEMBL30722421 0.79 MAPT (0.78) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL13419653 0.79 ALDH1A1 (0.48) MAPTALDH1A1LMNAKMT2ACKS1B

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