SCHEMBL31318337

SCHEMBL31318337

O=CN1CCC(c2nc3ccccc3nc2Cl)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
HTR3B O95264 1/20 0.38
HTR3A P46098 1/20 0.38
HRH4 Q9H3N8 1/20 0.38
MAPT P10636 1/20 0.36
LCK P06239 2/20 0.35
KDM4E B2RXH2 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
CNR2 P34972 2/20 0.34
TP53 P04637 1/20 0.33
UBE2M P61081 1/20 0.33
DCUN1D1 Q96GG9 1/20 0.33
PDE2A O00408 1/20 0.33
PDE1B Q01064 1/20 0.33
PDE4D Q08499 1/20 0.33
PDE10A Q9Y233 1/20 0.33
CNR1 P21554 1/20 0.33
LMNA P02545 1/20 0.33
FABP4 P15090 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
SCHEMBL12410054 0.82 TDP1 (0.56) TDP1HTR3BHTR3AHRH4MAPT
SCHEMBL31318334 0.78 LMNA (0.43) TDP1MAPTKDM4EPKMRAB9A
SCHEMBL21649751 0.72 HTR2B (0.57) PKMHTR2B
SCHEMBL7697729 0.70 TDP1 (0.50) TDP1HTR3BHTR3AHRH4MAPT
SCHEMBL2590292 0.70 PDE10A (0.45) TDP1MAPTKDM4EPKMTP53
SCHEMBL3710421 0.68 SLC18A3 (0.52)
SCHEMBL10395945 0.66 DDB1 (0.36) HTR3BHTR3AKDM4ECNR2TLR8
Phenazine SCHEMBL28562393 0.65 HTR3A (0.46) TDP1HTR3BHTR3AMAPTKDM4E
SCHEMBL28975864 0.65 DRD4 (0.46)
SCHEMBL10634556 0.64 HTR2A (0.53)

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
CN-119306698-A Novel method for preparing zavigpam intermediate 浙江工业大学 2025-01-14 CN disclosed