SCHEMBL8871017

SCHEMBL8871017

Fc1ccc2[nH]c(C3CCN(CCCc4c[nH]c5ccc(F)cc45)CC3)cc2c1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 8/20 0.68
MPO P05164 5/20 0.65
SLC6A4 P31645 2/20 0.63
HTR7 P34969 2/20 0.63
KCNH2 Q12809 2/20 0.63
HTR6 P50406 1/20 0.53

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
SCHEMBL8871701 0.97 HTR1A (0.64) HTR1AMPOSLC6A4HTR7KCNH2
SCHEMBL8871437 0.94 MPO (0.64) HTR1AMPOSLC6A4HTR7KCNH2
SCHEMBL8871262 0.93 HTR1A (0.67) HTR1AMPOSLC6A4HTR7KCNH2
SCHEMBL8871148 0.87 HTR7 (0.56) HTR1AMPOSLC6A4HTR7KCNH2
SCHEMBL8871338 0.87 HTR1A (0.58) HTR1AMPOSLC6A4HTR7KCNH2
SCHEMBL8870468 0.86 HTR1A (0.64) HTR1AMPOSLC6A4HTR7KCNH2
SCHEMBL8872120 0.85 HTR7 (0.52) HTR1AMPOSLC6A4HTR7
SCHEMBL8557344 0.84 HTR1A (0.76) HTR1AMPOSLC6A4HTR7KCNH2
SCHEMBL8870689 0.83 HTR1A (0.58) HTR1AKCNH2HTR6
SCHEMBL8870688 0.83 HTR1A (0.70) HTR1A

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
US-5693655-A 3-indolylpiperidines MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1997-12-02 US disclosed