SCHEMBL8453682

SCHEMBL8453682

FCC/C=C/[C@H]1CC[C@H](c2ccc(-c3ccc(Cl)cc3)cc2)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 1/20 0.37
DRD2 P14416 3/20 0.37
SLC18A3 Q16572 1/20 0.35
LSS P48449 1/20 0.33
HDAC2 Q92769 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
SLC2A1 P11166 1/20 0.33
MAPT P10636 2/20 0.32
HTR1A P08908 2/20 0.32
HTR2A P28223 2/20 0.32
DRD3 P35462 2/20 0.32
DRD1 P21728 1/20 0.32
DRD5 P21918 1/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 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
SCHEMBL8453693 1.00 HTR3A (0.37) HTR3ADRD2SLC18A3LSSHDAC2
SCHEMBL8453684 1.00 HTR3A (0.37) HTR3ADRD2SLC18A3LSSHDAC2
SCHEMBL8453696 1.00 HTR3A (0.37) HTR3ADRD2SLC18A3LSSHDAC2
SCHEMBL8453005 0.92 DRD2 (0.35) HTR3ADRD2SLC18A3LSSHDAC2
SCHEMBL8453001 0.92 DRD2 (0.35) HTR3ADRD2SLC18A3LSSHDAC2
SCHEMBL8452994 0.92 DRD2 (0.35) HTR3ADRD2SLC18A3LSSHDAC2
SCHEMBL8452989 0.92 DRD2 (0.35) HTR3ADRD2SLC18A3LSSHDAC2
SCHEMBL8449191 0.89 ESR2 (0.37) HTR3ADRD2SLC18A3LSSHDAC2
SCHEMBL8449197 0.89 ESR2 (0.37) HTR3ADRD2SLC18A3LSSHDAC2
SCHEMBL8449186 0.89 ESR2 (0.37) HTR3ADRD2SLC18A3LSSHDAC2

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-0679707-B1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 1999-06-16 EP disclosed
US-5720899-A Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1998-02-24 US disclosed
US-5653911-A Liquid crystalline compound liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1997-08-05 US disclosed
EP-0679707-A1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element Chisso Corporation (JP) 1995-11-02 EP disclosed