SCHEMBL14344293

SCHEMBL14344293

Nc1ccc(CC2CCC(N)[C@@H](CC3CCC(N)CC3)C2)cc1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL40071 1.00 HTR6 (0.33) HTR6MEN1KMT2A
SCHEMBL40077 0.81 MEN1 (0.44) HTR6MEN1KMT2A
Ammonia Solution, Strong SCHEMBL14343979 0.79 MEN1 (0.43) HTR6MEN1KMT2A
SCHEMBL8079322 0.77 MEN1 (0.36) HTR6MEN1KMT2A
SCHEMBL14407436 0.76 CYP3A4 (0.52) HTR6MEN1KMT2A
SCHEMBL39986 0.75
SCHEMBL7446113 0.73 MEN1 (0.49) HTR6MEN1KMT2A
SCHEMBL10025869 0.68
SCHEMBL342929 0.67 ALDH1A1 (0.40) HTR6
SCHEMBL7438487 0.66 NFE2L2 (0.47) HTR6MEN1KMT2A

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
WO-2007143416-A2 ORGANICALLY MODIFIED SILICA AND USE THEREOF NALCO COMPANY (US) 2007-12-13 WO disclosed