SCHEMBL7937330

SCHEMBL7937330

CC(=O)c1ccc2c(c1C(C)=O)Cc1ccccc1-2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.51
NPC1 O15118 5/20 0.51
HTR2B P41595 3/20 0.44
HTR7 P34969 2/20 0.44
HTR2C P28335 2/20 0.44
CYP1A2 P05177 2/20 0.44
ADRA2A P08913 1/20 0.44
MAOA P21397 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
PNMT P11086 1/20 0.42
SRD5A2 P31213 1/20 0.41
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 3/20 0.39
MAPK1 P28482 1/20 0.39
DRD2 P14416 1/20 0.39
ADRA1D P25100 1/20 0.39
HTR2A P28223 1/20 0.39
ADRA1A P35348 1/20 0.39
ADRA1B P35368 1/20 0.39

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
SCHEMBL7796635 0.83 RAB9A (0.50) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL3704663 0.83 RAB9A (0.50) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL1608310 0.83 NPC1 (0.50) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL3491774 0.81 NPC1 (0.59) RAB9ANPC1HTR2BHTR7HTR2C
Fluorene SCHEMBL28131122 0.80 RAB9A (0.58) RAB9ANPC1HTR2BHTR7HTR2C
Ammonia Solution, Strong SCHEMBL27320939 0.80 NPC1 (0.58) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL3720118 0.79 HSP90AA1 (0.50) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL31158183 0.79 HSP90AA1 (0.50) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL30647966 0.77 HTR2B (0.51) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL31301114 0.77 NPC1 (0.45) RAB9ANPC1HTR2BHTR7HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0666267-B1 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 2001-04-18 EP disclosed
CN-1060176-C Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 2001-01-03 CN disclosed
US-5571880-A CATALYSTS FOR POLYMERIZATION OF OLEFINS ESPECIALLY TO OBTAIN SYNDIOTACTIC POLYMERS PHILLIPS PETROLEUM COMPANY (US) 1996-11-05 US disclosed
CN-1109472-A Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 1995-10-04 CN disclosed
EP-0666267-A2 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1995-08-09 EP disclosed
US-4064347-A Bis-basic ketones of fluorene and fluorenone RICHARDSON-MERRELL INC. (US) 1977-12-20 US disclosed