SCHEMBL8416167

SCHEMBL8416167

Cc1cccc2c1-c1ccccc1C2c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.42
HTR2B P41595 2/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
ADRA2C P18825 1/20 0.40
PTGS2 P35354 1/20 0.40
HRH1 P35367 1/20 0.40
HTR3A P46098 1/20 0.40
PDE4D Q08499 1/20 0.40
NR3C1 P04150 1/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP19A1 P11511 1/20 0.36

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
SCHEMBL19303774 0.79 MAPK1 (0.39) HTR2BLMNATP53CYP1A2CYP3A4
SCHEMBL18574577 0.79 LMNA (0.39) HTR2BLMNATP53CYP1A2CYP3A4
SCHEMBL28773419 0.79 HTR2B (0.39) MYCHTR2BLMNATP53CYP1A2
SCHEMBL25171318 0.79 LMNA (0.54) HTR2BLMNATP53CYP1A2CYP3A4
SCHEMBL70993 0.79 LMNA (0.54) HTR2BLMNATP53CYP1A2CYP3A4
SCHEMBL29370508 0.79 LMNA (0.54) HTR2BLMNATP53CYP1A2CYP3A4
SCHEMBL29246531 0.78 HTR2A (0.40) HTR2BLMNATP53CYP1A2CYP3A4
SCHEMBL7873616 0.76 MYC (0.40) MYCHTR2BLMNANR3C1MEN1
SCHEMBL2804918 0.75 SCN8A (0.38) LMNATP53MAPK1NR3C1MEN1
SCHEMBL7529078 0.75 LMNA (0.36) HTR2BLMNATP53CYP1A2CYP3A4

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