SCHEMBL8416176

SCHEMBL8416176

Cc1cccc2c1-c1ccccc1C2C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.38
TDO2 P48775 2/20 0.38
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
PRCP P42785 1/20 0.36
NOS2 P35228 1/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
HTR2C P28335 4/20 0.34
HTR2A P28223 2/20 0.33
HTR2B P41595 2/20 0.33
HRH3 Q9Y5N1 2/20 0.33
MYC P01106 1/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 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
SCHEMBL23704622 0.80 BCHE (0.52) IDO1TDO2BCHEACHEPRCP
SCHEMBL8416138 0.80 BCHE (0.52) IDO1TDO2BCHEACHEPRCP
SCHEMBL2806911 0.79 NOS2 (0.36) PRCPNOS2HTR2CHTR2AHTR2B
SCHEMBL28225513 0.78 BCHE (0.48) IDO1TDO2BCHEACHEPRCP
Hydrochloric Acid SCHEMBL8853642 0.76 IDO1 (0.33) IDO1TDO2BCHEACHEPRCP
SCHEMBL28142477 0.74 BCHE (0.44) IDO1TDO2BCHEACHEPRCP
SCHEMBL29988938 0.71 ALDH1A1 (0.41) IDO1TDO2BCHEACHEPRCP
SCHEMBL7873616 0.70 MYC (0.40) ACHEHTR2CHTR2AHTR2BMYC
SCHEMBL28946001 0.69 SLC18A3 (0.44) IDO1TDO2BCHEACHESIGMAR1
Biphenyl SCHEMBL9937258 0.68 HTR2C (0.58) PRCPDDB1CRBNHTR2CHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0627440-B1 Metallocenes containing 9-substituted fluorenyl compounds and use of the metallocenes PHILLIPS PETROLEUM CO (US) 1999-08-18 EP disclosed
US-5610247-A Unbridged metallocenes of 9-substituted fluorenyl compounds and use thereof PHILLIPS PETROLEUM COMPANY (US) 1997-03-11 US disclosed
EP-0627440-A1 9-Substituted fluorenyl compounds and the preparation and use of metallocenes thereof PHILLIPS PETROLEUM COMPANY (US) 1994-12-07 EP disclosed