SCHEMBL8945096

SCHEMBL8945096

CCCc1ccccc1C1CCCCC1(C)Cc1ccc(N)cc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.33
ALDH1A1 P00352 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL8945269 0.86 HTR6 (0.32) HTR6
SCHEMBL8945429 0.85 SLC10A2 (0.32) HTR6
SCHEMBL8945265 0.83 HTR6 (0.36) HTR6ALDH1A1MAOAMAOBMAPK1
SCHEMBL8945333 0.81 KDM1A (0.41) HTR6ALDH1A1MAOAMAOBMAPK1
SCHEMBL8945087 0.77 SLC10A2 (0.35) HTR6MAPK1
SCHEMBL8945125 0.76 GSK3B (0.34) HTR6ALDH1A1MAPK1
SCHEMBL8945071 0.71 SLC10A2 (0.33) HTR6ALDH1A1
SCHEMBL8945227 0.70 HTR6 (0.34) HTR6ALDH1A1
SCHEMBL8945308 0.70 KDM1A (0.40) HTR6
SCHEMBL8944930 0.69 KDM1A (0.44) HTR6ALDH1A1

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-5501884-A Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORPORATION (JP) 1996-03-26 US disclosed