SCHEMBL8809389

SCHEMBL8809389

Cc1sc2nc(C(C)C)cn2c1CCN1CCC(c2coc3cc(F)ccc23)CC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 12/20 0.39
SLC6A4 P31645 5/20 0.39
CTSS P25774 1/20 0.37
HTR2A P28223 10/20 0.36
HTR7 P34969 8/20 0.36
KCNH2 Q12809 8/20 0.36
ACHE P22303 2/20 0.36
DRD3 P35462 2/20 0.36

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
SCHEMBL8809944 0.85 DRD2 (0.57) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL8809987 0.85 DRD2 (0.39) DRD2SLC6A4CTSSHTR2AHTR7
SCHEMBL8808427 0.77 CTSS (0.38) DRD2SLC6A4CTSSHTR2AHTR7
SCHEMBL8808853 0.75 DRD2 (0.62) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL7699932 0.71 DRD2 (0.55) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL7697170 0.71 DRD2 (0.53) DRD2SLC6A4HTR2AHTR7KCNH2
SCHEMBL6890629 0.71 CTSS (0.43) DRD2SLC6A4CTSSHTR2AACHE
SCHEMBL8810725 0.70 DRD2 (0.39) DRD2SLC6A4CTSSHTR2AHTR7
SCHEMBL6898517 0.70 HTR2A (0.46) DRD2SLC6A4CTSSHTR2AKCNH2
SCHEMBL7701569 0.70 HTR2C (0.61) DRD2SLC6A4HTR2AHTR7KCNH2

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