SCHEMBL8765847

SCHEMBL8765847

CCc1ccccc1C1(c2ccccc2CC)CCC(CC)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.44
CYP2D6 P10635 1/20 0.41
MAPT P10636 3/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 2/20 0.38
ALOX12 P18054 1/20 0.38
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PDK2 Q15119 2/20 0.34
CTSB P07858 1/20 0.33
OPRM1 P35372 3/20 0.33
OPRK1 P41145 3/20 0.33
OPRL1 P41146 3/20 0.33
LMNA P02545 2/20 0.33
GABRA1 P14867 2/20 0.32
GABRB2 P47870 2/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 2/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL8766466 0.88 HDAC4 (0.44) HDAC4CYP2D6MAPTALDH1A1PDK2
SCHEMBL8766761 0.86 KDM4E (0.37) HDAC4MAPTKDM4EALDH1A1GAA
SCHEMBL8767265 0.86 HDAC4 (0.44) HDAC4CYP2D6MAPTKDM4EPDK2
SCHEMBL8766329 0.85 HDAC4 (0.39) HDAC4CYP2D6MAPTGAAHPGD
SCHEMBL8766477 0.84 HDAC4 (0.38) HDAC4CYP2D6
SCHEMBL8766390 0.83 HDAC4 (0.38) HDAC4CYP2D6
SCHEMBL8767261 0.83 HDAC4 (0.38) HDAC4CYP2D6
SCHEMBL8766110 0.83 HDAC4 (0.38) HDAC4CYP2D6
SCHEMBL8766901 0.80 OPRM1 (0.42) HDAC4MAPTKDM4EALDH1A1GAA
SCHEMBL8766383 0.79 HDAC4 (0.56) HDAC4CYP2D6MAPTKDM4EPDK2

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