SCHEMBL8570252

SCHEMBL8570252

Cc1cc(C)cc(-c2cc(Cl)n3nccc3n2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.56
RAD52 P43351 4/20 0.42
S100A4 P26447 1/20 0.42
KCNN3 Q9UGI6 4/20 0.39
PIK3CG P48736 1/20 0.39
HTR1D P28221 2/20 0.35
HTR3A P46098 2/20 0.35
HTR6 P50406 2/20 0.35
TMEM97 Q5BJF2 2/20 0.35
HTR1A P08908 1/20 0.35
DRD2 P14416 1/20 0.35
HTR1B P28222 1/20 0.35
MAPK8 P45983 1/20 0.35
SLC6A3 Q01959 1/20 0.35
BTK Q06187 1/20 0.35
MRGPRX2 Q96LB1 1/20 0.35
ADRA1B P35368 1/20 0.35
DYRK1A Q13627 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 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
SCHEMBL7849116 0.81 ALDH1A1 (0.51) PDE10ARAD52S100A4PIK3CGHTR1D
SCHEMBL5460421 0.81 PDE10A (0.59) PDE10ARAD52KCNN3PIK3CGHTR1D
SCHEMBL312516 0.81 PDE10A (0.64) PDE10ARAD52PIK3CGKDM4EALDH1A1
SCHEMBL8569589 0.81 PDE10A (0.51) PDE10AKCNN3PIK3CGCYP2C19NPC1
SCHEMBL659433 0.80 PDE10A (0.67) PDE10AKCNN3PIK3CGKDM4EALDH1A1
SCHEMBL13304943 0.79 PDE10A (0.53) PDE10ARAD52KCNN3PIK3CGHTR1D
SCHEMBL8574299 0.79 PIK3CG (0.51) PDE10AKCNN3PIK3CGKDM4EMEN1
SCHEMBL13778098 0.78 PDE10A (0.56) PDE10ARAD52KCNN3PIK3CGHTR1D
SCHEMBL28449011 0.78 CCNT1 (0.53) PDE10APIK3CGDYRK1AKDM4EMEN1
SCHEMBL12953239 0.78 PDE10A (0.51) PDE10ARAD52PIK3CGHTR1DHTR3A

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
US-5843951-A Analgesic composition of pyrazolo(1,5-A) pyrimidines OTSUKA PHARMACEUTICAL FACTORY INC. (JP) 1998-12-01 US disclosed
EP-0795555-A1 ANALGESICS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1997-09-17 EP disclosed