SCHEMBL8448972

SCHEMBL8448972

FCC/C=C/[C@H]1CC[C@H](c2ccc(F)c(F)c2)CC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
USP5 P45974 2/20 0.33
HDAC6 Q9UBN7 1/20 0.33
USP30 Q70CQ3 1/20 0.32
HDAC2 Q92769 1/20 0.31
HCRTR2 O43614 2/20 0.31
CCR2 P41597 1/20 0.31
KDM1A O60341 2/20 0.31
MAOB P27338 1/20 0.31
HTR1D P28221 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
SCHEMBL8448977 1.00 HTR2A (0.38) HTR2AHTR2CHTR2BUSP5HDAC6
SCHEMBL8448975 1.00 HTR2A (0.38) HTR2AHTR2CHTR2BUSP5HDAC6
SCHEMBL8448380 0.96 HTR2A (0.35) HTR2AHTR2CHTR2BUSP5HDAC6
SCHEMBL8448376 0.96 HTR2A (0.35) HTR2AHTR2CHTR2BUSP5HDAC6
SCHEMBL8449089 0.93 HTR2A (0.34) HTR2AHTR2CHTR2BUSP5HDAC6
SCHEMBL8449093 0.93 HTR2A (0.34) HTR2AHTR2CHTR2BUSP5HDAC6
SCHEMBL8449097 0.93 HTR2A (0.34) HTR2AHTR2CHTR2BUSP5HDAC6
SCHEMBL8449376 0.89 P2RY14 (0.33) HTR2AHTR2CHTR2BHDAC2KDM1A
SCHEMBL8449384 0.89 P2RY14 (0.33) HTR2AHTR2CHTR2BHDAC2KDM1A
SCHEMBL8449370 0.89 P2RY14 (0.33) HTR2AHTR2CHTR2BHDAC2KDM1A

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