SCHEMBL8766110

SCHEMBL8766110

CCCCCCCCC1CCC(c2ccccc2CC)(c2ccccc2CC)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.38
CYSLTR2 Q9NS75 1/20 0.36
CYSLTR1 Q9Y271 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
DRD2 P14416 1/20 0.36
CHRM3 P20309 1/20 0.36
DRD4 P21917 1/20 0.36
DRD3 P35462 1/20 0.36
CYP2D6 P10635 1/20 0.35
CYP1A2 P05177 1/20 0.35
GRM2 Q14416 3/20 0.34
SIGMAR1 Q99720 2/20 0.34
LIPG Q9Y5X9 1/20 0.33
KCNH2 Q12809 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C8 P10632 1/20 0.33
S1PR3 Q99500 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
SCHEMBL8766390 1.00 HDAC4 (0.38) HDAC4CYSLTR2CYSLTR1CHRM2CHRM4
SCHEMBL8767261 1.00 HDAC4 (0.38) HDAC4CYSLTR2CYSLTR1CHRM2CHRM4
SCHEMBL8766477 0.99 HDAC4 (0.38) HDAC4CYSLTR2CYSLTR1CHRM2CHRM4
SCHEMBL8766329 0.94 HDAC4 (0.39) HDAC4CHRM2CHRM4CHRM5CHRM1
SCHEMBL8766504 0.90 LIPG (0.36) CYSLTR2CYSLTR1CHRM2CHRM4CHRM5
SCHEMBL8766414 0.90 LIPG (0.36) CYSLTR2CYSLTR1CHRM2CHRM4CHRM5
SCHEMBL8766507 0.90 LIPG (0.36) CYSLTR2CYSLTR1CHRM2CHRM4CHRM5
SCHEMBL8766367 0.89 BCHE (0.35) CYSLTR2CYSLTR1CHRM2CHRM4CHRM5
SCHEMBL8766466 0.88 HDAC4 (0.44) HDAC4CHRM2CHRM4CHRM5CHRM1
SCHEMBL8766372 0.84 HRH3 (0.38) CHRM2CHRM4CHRM5CHRM1DRD2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0601813-B1 Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORP (JP) 1997-08-13 EP disclosed
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
US-5382688-A Diamino compounds and their production method CHISSO CORPORATION (JP) 1995-01-17 US disclosed
EP-0601813-A1 Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORPORATION (JP) 1994-06-15 EP disclosed