SCHEMBL6673853

SCHEMBL6673853

C1=CCC(CCC2c3ccccc3-c3ccccc32)=C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 9/20 0.40
HRH1 P35367 7/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
GPR3 P46089 1/20 0.32
TDO2 P48775 1/20 0.32
KDM4E B2RXH2 2/20 0.32
CHRM2 P08172 2/20 0.32
CHRM1 P11229 2/20 0.32
SLC6A2 P23975 2/20 0.32
ADRA1A P35348 2/20 0.32
DRD3 P35462 2/20 0.32
SLC6A3 Q01959 2/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
DRD2 P14416 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32

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
Hydrochloric Acid SCHEMBL9067829 0.97 HTR2A (0.38) HTR2AHRH1CA1CA2GPR3
SCHEMBL6671928 0.92 HTR2A (0.39) HTR2AHRH1CA1CA2GPR3
SCHEMBL6672355 0.90 HTR2A (0.38) HTR2AHRH1CA1CA2GPR3
SCHEMBL6677847 0.89 HTR2A (0.37) HTR2AHRH1CA1CA2GPR3
SCHEMBL6673436 0.89 HTR2A (0.37) HTR2AHRH1CA1CA2GPR3
SCHEMBL3994179 0.83 HTR2A (0.42) HTR2ACA1CA2GPR3TDO2
SCHEMBL8439620 0.81 HTR2A (0.41) HTR2ACA1CA2GPR3CHRM2
Hydrochloric Acid SCHEMBL7940379 0.81 SLC6A4 (0.30) SLC6A4
Hydrochloric Acid SCHEMBL6560684 0.80 HTR2A (0.40) HTR2ACA1CA2GPR3CHRM2
Hydrochloric Acid SCHEMBL7939927 0.80 HTR2A (0.40) HTR2ACA1CA2GPR3CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0963990-B1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL CO (JP) 2004-10-06 EP disclosed
EP-0666267-B1 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 2001-04-18 EP disclosed
US-6197990-B1 REACTING CYCLOPENTADIENE AND METAL HYDRIDE IN PRESENCE OF AMINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-03-06 US disclosed
EP-0726271-B1 Organoaluminoxy product, catalyst systems, preparation, and use PHILLIPS PETROLEUM CO (US) 2000-05-24 EP disclosed
CN-1050360-C Organoaluminoxy product, catalyst systems, preparation, and use PHILLIPS PETROLEUM CO (US) 2000-03-15 CN disclosed
EP-0963990-A1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-12-15 EP disclosed
US-5670589-A COORDINATION POLYMERIZATION CATALYST PHILLIPS PETROLEUM COMPANY (US) 1997-09-23 US disclosed
US-5571880-A CATALYSTS FOR POLYMERIZATION OF OLEFINS ESPECIALLY TO OBTAIN SYNDIOTACTIC POLYMERS PHILLIPS PETROLEUM COMPANY (US) 1996-11-05 US disclosed
CN-1131670-A Organoaluminoxy product, catalyst systems, preparation, and use PHILLIPS PETROLEUM CO (US) 1996-09-25 CN disclosed
EP-0726271-A1 Organoaluminoxy product, catalyst systems, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1996-08-14 EP disclosed
EP-0666267-A2 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1995-08-09 EP disclosed