SCHEMBL7647630

SCHEMBL7647630

CCC1=Cc2ccccc2C1c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.43
HTR2A P28223 7/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
HTR7 P34969 1/20 0.34
HTR2B P41595 1/20 0.34
PTGS2 P35354 1/20 0.32
DRD2 P14416 3/20 0.32
DRD4 P21917 3/20 0.32
HRH1 P35367 2/20 0.31
HTR2C P28335 1/20 0.31
DRD3 P35462 1/20 0.31
MTNR1A P48039 1/20 0.31
MTNR1B P49286 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL8774021 0.68 PNMT (0.46) PNMTHTR2ANPC1RAB9AHTR7
SCHEMBL6650492 0.68 PNMT (0.46) PNMTHTR2ANPC1RAB9AHTR7
SCHEMBL633763 0.68 PNMT (0.68) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL30606684 0.68 PNMT (0.68) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL8734338 0.68 KDM4E (0.33) KDM4EALDH1A1MAPTHPGD
SCHEMBL6638923 0.68 PNMT (0.37) PNMTNPC1RAB9AHTR7HTR2B
Iodide SCHEMBL3382482 0.67 PNMT (0.52) PNMTHTR2ANPC1RAB9AHTR7
Fluoride Ion SCHEMBL3384402 0.67 PNMT (0.52) PNMTHTR2ANPC1RAB9AHTR7
Hydrochloric Acid SCHEMBL30274953 0.67 PNMT (0.52) PNMTHTR2ANPC1RAB9AHTR7
Hydrochloric Acid SCHEMBL3385861 0.67 PNMT (0.52) PNMTHTR2ANPC1RAB9AHTR7

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-6403734-B1 POLYMERIZING ALPHA-OLEFIN BY CONTACTING WITH CATALYST SYSTEM COMPRISING BRIDGED FLUORENYL METALLOCENE CONTAINING METAL OF GROUP 4 OR 5 AND SUITABLE COCATALYST PHILLIPS PETROLEUM COMPANY 2002-06-11 US claimed
CN-1060176-C Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 2001-01-03 CN disclosed
CN-1109472-A Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 1995-10-04 CN disclosed
CN-1068829-A Organometallic fluorenyl compounds and preparation thereof and application PHILLIPS PETROLEUM CO (US) 1993-02-10 CN disclosed