SCHEMBL8552184

SCHEMBL8552184

Nc1nc(-c2ccc(F)cc2)c(C2CCN(Cc3ccccc3)C2)s1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 4/20 0.61
HTR2A P28223 1/20 0.61
PRCP P42785 2/20 0.48
MAPK14 Q16539 1/20 0.47
ACHE P22303 4/20 0.46
BCHE P06276 3/20 0.46
BACE1 P56817 3/20 0.46
DRD2 P14416 2/20 0.45
EGFR P00533 1/20 0.44
SLC18A3 Q16572 2/20 0.43
DRD3 P35462 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
HTR6 P50406 1/20 0.43
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL7516300 0.76 HTR2A (1.00) DRD4HTR2ADRD2DRD3MEN1
Hydrochloric Acid SCHEMBL8552262 0.75 HTR2A (0.98) DRD4HTR2ADRD2DRD3MEN1
SCHEMBL8556407 0.73 DRD4 (0.59) DRD4HTR2AMAPK14KDM4EMEN1
SCHEMBL8558550 0.72 HTR2A (0.59) DRD4HTR2APRCPDRD2HTR6
SCHEMBL8557341 0.71 PRCP (0.55) DRD4PRCPDRD2DRD3ALDH1A1
SCHEMBL19493714 0.70 SLC18A3 (0.70) DRD4ACHEBCHEBACE1SLC18A3
SCHEMBL8434654 0.70 DRD4 (0.52) DRD4HTR2AKDM4EMEN1ALDH1A1
SCHEMBL8554786 0.69 HTR2A (0.47) DRD4HTR2AMAPK14
SCHEMBL22778175 0.68 CNR2 (0.60) DRD4HTR2AACHEBCHEBACE1
SCHEMBL22795424 0.68 CNR2 (0.60) DRD4HTR2AACHEBCHEBACE1

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
EP-0816362-A1 THIAZOLE DERIVATIVES TAISHO PHARMACEUTICAL CO. LTD (JP) 1998-01-07 EP disclosed