SCHEMBL14334352

SCHEMBL14334352

CC1CN(c2ccc3c(c2)CCNCC3)C(=O)O1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 15/20 0.66
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
HTR2C P28335 3/20 0.37
HTR2B P41595 2/20 0.37
HTR2A P28223 1/20 0.37

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
SCHEMBL14334666 0.85 HTR6 (0.57) HTR6
SCHEMBL14334868 0.83 HTR6 (0.46) HTR6MAOAMAOB
SCHEMBL3718329 0.82 HTR6 (0.46) HTR6MAOAMAOB
SCHEMBL14335098 0.81 HTR6 (0.62) HTR6HTR2CHTR2BHTR2A
SCHEMBL14334647 0.81 HTR6 (0.62) HTR6MAOAMAOB
SCHEMBL6295375 0.79 HTR6 (0.57) HTR6MAOAMAOB
SCHEMBL14334882 0.77 HTR6 (0.41) HTR6
SCHEMBL5141633 0.77 MAOA (0.56) HTR6MAOAMAOB
SCHEMBL6208847 0.77 MAOA (0.56) HTR6MAOAMAOB
SCHEMBL14334461 0.76 HTR6 (0.41) HTR6MAOAMAOB

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-7304050-B2 Antibacterial agents PFIZER INC. (US) 2007-12-04 US disclosed