SCHEMBL31662946

SCHEMBL31662946

Cc1nc(CN2CCC(c3cc(-c4cccnc4)[nH]n3)CC2)nc2c(F)cccc12

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 3/20 0.41
DRD2 P14416 3/20 0.40
DRD4 P21917 3/20 0.40
DRD3 P35462 2/20 0.40
AKT1 P31749 1/20 0.40
AKT2 P31751 1/20 0.40
TLR7 Q9NYK1 5/20 0.39
ACHE P22303 2/20 0.39
GSK3B P49841 1/20 0.39
CYP11B2 P19099 1/20 0.39
TLR9 Q9NR96 1/20 0.37
USP30 Q70CQ3 1/20 0.36
LMNA P02545 1/20 0.35
GBA1 P04062 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
WNT1 P04628 2/20 0.35
DYRK1A Q13627 2/20 0.35

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
SCHEMBL31663134 0.87 DRD2 (0.47) PIM1DRD2DRD4DRD3AKT1
SCHEMBL31663092 0.87 DRD2 (0.47) PIM1DRD2DRD4DRD3AKT1
SCHEMBL31662653 0.76 DRD2 (0.47) DRD2DRD4DRD3AKT1AKT2
SCHEMBL8549897 0.74 DRD2 (0.52) PIM1DRD2DRD4DRD3AKT1
SCHEMBL31663004 0.73 DRD2 (0.45) PIM1DRD2DRD4DRD3AKT1
SCHEMBL31663162 0.73 PIM1 (0.42) PIM1DRD2DRD4DRD3AKT1
SCHEMBL31662758 0.73 AKT1 (0.42) PIM1DRD2DRD4DRD3AKT1
SCHEMBL31663408 0.71 DRD2 (0.46) DRD2DRD4DRD3AKT1AKT2
SCHEMBL27955820 0.70 ALDH1A1 (0.54) PIM1CYP11B2
SCHEMBL8547063 0.69 DRD4 (0.57) DRD2DRD4DRD3AKT1AKT2

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 disclosed