SCHEMBL8835703

SCHEMBL8835703

CC/C=C/C=C/C1CCC(c2ccc(F)c(F)c2)CC1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 3/20 0.34
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
USP5 P45974 2/20 0.32
HDAC6 Q9UBN7 1/20 0.32
USP30 Q70CQ3 1/20 0.31
ADRA1A P35348 1/20 0.30
HDAC2 Q92769 1/20 0.30
CCR2 P41597 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
SCHEMBL8835711 1.00 HCRTR2 (0.34) HCRTR2HTR2AHTR2CHTR2BUSP5
SCHEMBL4921898 0.90 HTR2A (0.36) HCRTR2HTR2AHTR2CHTR2BUSP5
SCHEMBL9480887 0.86 USP5 (0.34) HCRTR2HTR2AHTR2CHTR2BUSP5
SCHEMBL9480907 0.86 USP5 (0.34) HCRTR2HTR2AHTR2CHTR2BUSP5
SCHEMBL14316105 0.86 USP5 (0.34) HCRTR2HTR2AHTR2CHTR2BUSP5
SCHEMBL8771249 0.86 USP5 (0.34) HCRTR2HTR2AHTR2CHTR2BUSP5
SCHEMBL8835137 0.86 KDM1A (0.41) HTR2A
SCHEMBL8835140 0.86 KDM1A (0.41) HTR2A
SCHEMBL8836077 0.86
SCHEMBL8836069 0.86

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
US-5662830-A Diene derivative CHISSO CORPORATION (JP) 1997-09-02 US disclosed
US-5609791-A Diene derivative CHISSO CORPORATION (JP) 1997-03-11 US disclosed
EP-0563982-B1 Polycyclic diene derivatives CHISSO CORP (JP) 1996-07-17 EP disclosed
US-5449810-A Diene derivative CHISSO CORPORATION (JP) 1995-09-12 US disclosed