SCHEMBL8945404

SCHEMBL8945404

CCC1(Cc2ccc(N)cc2)CCCC(c2ccccc2C)C1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.35
HTR6 P50406 1/20 0.33
HDAC4 P56524 1/20 0.33
HSD11B1 P28845 1/20 0.31
HTR2A P28223 1/20 0.30
HTR2B P41595 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
SCHEMBL8945195 0.91 HTR2C (0.33) HTR2CHTR6HDAC4
SCHEMBL8945008 0.89 HTR2C (0.32) HTR2CHTR6HDAC4
SCHEMBL8945127 0.88 CYP19A1 (0.32) HTR2CHTR6HDAC4
SCHEMBL8945363 0.87 CYP19A1 (0.33) HTR2CHDAC4HTR2A
SCHEMBL8945274 0.87 CYP19A1 (0.33) HTR2CHDAC4HTR2A
SCHEMBL8945226 0.87 CYP19A1 (0.33) HTR2CHDAC4HTR2A
SCHEMBL8945420 0.85 HTR2C (0.41) HTR2CHTR6HDAC4HSD11B1HTR2A
SCHEMBL8945209 0.83 HTR2C (0.36) HTR2CHTR6HDAC4HSD11B1HTR2A
SCHEMBL8945208 0.79 HTR2C (0.40) HTR2CHTR6HDAC4HSD11B1HTR2A
SCHEMBL8945021 0.77 HTR2C (0.38) HTR2CHTR6HDAC4HTR2AHTR2B

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