SCHEMBL30488646

SCHEMBL30488646

Fc1cccc2c1-c1cccc([Zr+3])c1C2

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.36
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
PNMT P11086 1/20 0.32
HTR1A P08908 3/20 0.31
HTR7 P34969 3/20 0.31
DRD2 P14416 1/20 0.31
DRD3 P35462 1/20 0.31
SRD5A1 P18405 1/20 0.30
PDK2 Q15119 1/20 0.30
TYMS P04818 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
SCHEMBL9810975 0.75 MAOA (0.46) PGRCA1CA2CA7CA9
Fluoride Ion SCHEMBL3384054 0.73 PNMT (0.52) PGRCA1CA2PNMTHTR7
Hydrochloric Acid SCHEMBL3384912 0.73 PNMT (0.52) PGRCA1CA2PNMTHTR7
Bromide SCHEMBL3385664 0.73 PNMT (0.52) PGRCA1CA2PNMTHTR7
Iodide SCHEMBL3385386 0.73 PNMT (0.52) PGRCA1CA2PNMTHTR7
Hydrochloric Acid SCHEMBL30811904 0.73 PNMT (0.52) PGRCA1CA2PNMTHTR7
SCHEMBL6558006 0.71 PGR (0.42) PGRCA1CA2HTR7DRD2
SCHEMBL6558028 0.71 PGR (0.39) PGRHTR7DRD2DRD3SRD5A1
SCHEMBL4011638 0.69 DRD2 (0.34) PGRCA1CA2DRD2DRD3
SCHEMBL22539769 0.69 PGR (0.43) PGRPNMTPDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116410223-A Tetraarylethoxy side chain single metallocene compound, catalyst system containing same and polyolefin synthesis method using same 中国石油天然气股份有限公司 2023-07-11 CN disclosed