SCHEMBL7019936

SCHEMBL7019936

CC(C)[Si](C(C)C)(C(C)C)n1cc(C2CCN(C)CC2)c2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 8/20 0.41
DRD2 P14416 3/20 0.39
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.37
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 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
SCHEMBL1413322 0.90 HTR6 (0.37) HTR6
SCHEMBL7710645 0.84 DRD2 (0.54) HTR6DRD2HTR2A
SCHEMBL6642794 0.82 DRD2 (0.43) HTR6DRD2HTR2ASLC6A4
SCHEMBL12127481 0.82 HTR1B (0.46) HTR6DRD2SLC6A4
SCHEMBL12127438 0.82 DRD2 (0.39) HTR6DRD2SLC6A4
SCHEMBL12128123 0.81 APP (0.46) HTR6DRD2SLC6A4
SCHEMBL12128118 0.80 APP (0.46) HTR6DRD2
SCHEMBL8182800 0.79 DRD2 (0.41) HTR6DRD2HTR2ASLC6A4
SCHEMBL7016909 0.78 DRD2 (0.53) HTR6DRD2HTR2ASLC6A4
SCHEMBL12127930 0.78 EED (0.39) HTR6DRD2

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-1089993-B1 5-HT1F AGONISTS LILLY CO ELI (US) 2003-10-22 EP disclosed