SCHEMBL31662760

SCHEMBL31662760

COc1c(-c2cc(C3CCN(Cc4nc(C)c5ccccc5n4)CC3)n[nH]2)c(C)nn1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.45
DRD4 P21917 7/20 0.45
DRD3 P35462 6/20 0.45
SLC6A4 P31645 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
GRM2 Q14416 2/20 0.35
AKT1 P31749 1/20 0.35
AKT2 P31751 1/20 0.35
AKT3 Q9Y243 1/20 0.35
TLR9 Q9NR96 2/20 0.34
TLR8 Q9NR97 2/20 0.34
TLR7 Q9NYK1 2/20 0.34
DPP4 P27487 1/20 0.34
FAP Q12884 1/20 0.34
TMEM97 Q5BJF2 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33

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 0.82 DRD2 (0.50) DRD2DRD4DRD3SLC6A4ALDH1A1
SCHEMBL31662792 0.80 DRD2 (0.47) DRD2DRD4DRD3SLC6A4ALDH1A1
SCHEMBL31663004 0.79 DRD2 (0.45) DRD2DRD4DRD3ALDH1A1HPGD
SCHEMBL31663111 0.78 DRD2 (0.45) DRD2DRD4DRD3SLC6A4ALDH1A1
SCHEMBL31662847 0.77 DRD2 (0.44) DRD2DRD4DRD3SLC6A4ALDH1A1
SCHEMBL31662653 0.76 DRD2 (0.47) DRD2DRD4DRD3ALDH1A1HPGD
SCHEMBL31663134 0.76 DRD2 (0.47) DRD2DRD4DRD3AKT1AKT2
SCHEMBL31663092 0.76 DRD2 (0.47) DRD2DRD4DRD3AKT1AKT2
SCHEMBL31663408 0.75 DRD2 (0.46) DRD2DRD4DRD3SLC6A4ALDH1A1
SCHEMBL31663310 0.68 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