SCHEMBL6672355

SCHEMBL6672355

C1=CCC(CCCCC2c3ccccc3-c3ccccc32)=C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 9/20 0.38
HRH1 P35367 7/20 0.36
KDM4E B2RXH2 2/20 0.33
CHRM2 P08172 2/20 0.33
CHRM1 P11229 2/20 0.33
SLC6A2 P23975 2/20 0.33
ADRA1A P35348 2/20 0.33
DRD3 P35462 2/20 0.33
SLC6A3 Q01959 2/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
DRD2 P14416 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
NFKB1 P19838 1/20 0.33
CHRM3 P20309 1/20 0.33
HTR2C P28335 1/20 0.33
THPO P40225 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
SCHEMBL6677847 0.98 HTR2A (0.37) HTR2AHRH1KDM4ECHRM2CHRM1
SCHEMBL6673436 0.98 HTR2A (0.37) HTR2AHRH1KDM4ECHRM2CHRM1
SCHEMBL6671928 0.95 HTR2A (0.39) HTR2AHRH1KDM4ECHRM2CHRM1
SCHEMBL6673853 0.90 HTR2A (0.40) HTR2AHRH1KDM4ECHRM2CHRM1
Hydrochloric Acid SCHEMBL9067829 0.88 HTR2A (0.38) HTR2AHRH1KDM4ECHRM2CHRM1
SCHEMBL3994179 0.80 HTR2A (0.42) HTR2ACHRM2CHRM1SLC6A2ADRA1A
SCHEMBL8439620 0.79 HTR2A (0.41) HTR2ACHRM2CHRM1SLC6A2ADRA1A
Hydrochloric Acid SCHEMBL9066834 0.78 HTR2A (0.40) HTR2ACHRM2CHRM1SLC6A2ADRA1A
Hydrochloric Acid SCHEMBL6560684 0.78 HTR2A (0.40) HTR2ACHRM2CHRM1SLC6A2ADRA1A
Hydrochloric Acid SCHEMBL7939927 0.78 HTR2A (0.40) HTR2ACHRM2CHRM1SLC6A2ADRA1A

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-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
US-6197990-B1 REACTING CYCLOPENTADIENE AND METAL HYDRIDE IN PRESENCE OF AMINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-03-06 US 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