SCHEMBL8809944

SCHEMBL8809944

Cc1sc2nc(C(C)C)cn2c1CCN1CCC(c2noc3cc(F)ccc23)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.57
SLC6A4 P31645 2/20 0.57
ACHE P22303 3/20 0.55
HTR2A P28223 15/20 0.53
HTR7 P34969 14/20 0.53
KCNH2 Q12809 12/20 0.53
SLC22A2 O15244 1/20 0.51
CACNA1F O60840 1/20 0.51
ADRB2 P07550 1/20 0.51
CHRM2 P08172 1/20 0.51
CHRM4 P08173 1/20 0.51
HTR1A P08908 1/20 0.51
CHRM5 P08912 1/20 0.51
ADRA2A P08913 1/20 0.51
CYP2D6 P10635 1/20 0.51
CHRM1 P11229 1/20 0.51
TSHR P16473 1/20 0.51
ADRA2B P18089 1/20 0.51
ADRA2C P18825 1/20 0.51
CHRM3 P20309 1/20 0.51

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
SCHEMBL8808853 0.91 DRD2 (0.62) DRD2SLC6A4ACHEHTR2AHTR7
SCHEMBL8809389 0.85 DRD2 (0.39) DRD2SLC6A4ACHEHTR2AHTR7
SCHEMBL8808675 0.85 DRD2 (0.61) DRD2SLC6A4ACHEHTR2AHTR7
SCHEMBL8810867 0.81 DRD2 (0.58) DRD2SLC6A4ACHEHTR2AHTR7
SCHEMBL8807844 0.80 DRD2 (0.61) DRD2SLC6A4ACHEHTR2AHTR7
SCHEMBL8808671 0.77 DRD2 (0.60) DRD2SLC6A4ACHEHTR2AHTR7
SCHEMBL8808524 0.77 DRD2 (0.54) DRD2SLC6A4ACHEHTR2AHTR7
SCHEMBL1545611 0.76 ACHE (0.93) DRD2SLC6A4ACHEHTR2AHTR7
SCHEMBL27443771 0.76 DRD2 (0.74) DRD2SLC6A4ACHEHTR2AHTR7
SCHEMBL1545164 0.74 DRD2 (0.76) DRD2SLC6A4ACHEHTR2AHTR7

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
EP-0794185-A1 BICYCLIC THIAZOLE COMPOUND MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-09-10 EP claimed
EP-0794185-A1 BICYCLIC THIAZOLE COMPOUND MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-09-10 EP disclosed