SCHEMBL31662792

SCHEMBL31662792

Cc1nsc(C)c1-c1cc(C2CCN(Cc3nc(C)c4ccccc4n3)CC2)n[nH]1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.47
DRD4 P21917 9/20 0.47
DRD3 P35462 8/20 0.47
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
GRM2 Q14416 2/20 0.37
SLC6A4 P31645 1/20 0.36
AKT1 P31749 1/20 0.36
AKT2 P31751 1/20 0.36
AKT3 Q9Y243 1/20 0.36
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
DPP4 P27487 2/20 0.34
CHRM1 P11229 1/20 0.34
ACHE P22303 2/20 0.34
NCF1 P14598 1/20 0.34
KDM4E B2RXH2 1/20 0.34
FAP Q12884 1/20 0.34

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
SCHEMBL31663193 0.85 DRD2 (0.50) DRD2DRD4DRD3ALDH1A1HPGD
SCHEMBL31662760 0.80 DRD2 (0.45) DRD2DRD4DRD3ALDH1A1HPGD
SCHEMBL31663134 0.79 DRD2 (0.47) DRD2DRD4DRD3AKT1AKT2
SCHEMBL31663092 0.79 DRD2 (0.47) DRD2DRD4DRD3AKT1AKT2
SCHEMBL31662653 0.79 DRD2 (0.47) DRD2DRD4DRD3ALDH1A1HPGD
SCHEMBL31663408 0.78 DRD2 (0.46) DRD2DRD4DRD3ALDH1A1HPGD
SCHEMBL31663111 0.77 DRD2 (0.45) DRD2DRD4DRD3ALDH1A1HPGD
SCHEMBL31663004 0.76 DRD2 (0.45) DRD2DRD4DRD3ALDH1A1HPGD
SCHEMBL31662847 0.76 DRD2 (0.44) DRD2DRD4DRD3ALDH1A1HPGD
SCHEMBL31663310 0.71 MAPT (0.43) DRD2DRD4DRD3ALDH1A1HPGD

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025149628-A1 PIPERIDINE DERIVATIVES AS INHIBITORS OF NICOTINAMIDE N-METHYL TRANSFERASE ASTRAZENECA AB (SE) 2025-07-17 WO claimed