SCHEMBL7597079

SCHEMBL7597079

CCC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Ti](C)(C)(=[SiH2])(c1ccccc1)(c1ccccc1)C1C(CC)=Cc2c(-c3cccc4ccccc34)cccc21

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.33
SLC6A4 P31645 1/20 0.33
HTR7 P34969 1/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31

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
SCHEMBL7600552 0.91 DRD2 (0.33) DRD2SLC6A4HTR7
SCHEMBL7597813 0.88 SLC6A4 (0.36) DRD2SLC6A4HTR7
SCHEMBL797387 0.85 CNR2 (0.33) DRD2SLC6A4HTR7
SCHEMBL797770 0.84 CNR2 (0.33) DRD2SLC6A4HTR7
SCHEMBL796750 0.82 CNR2 (0.35) DRD2SLC6A4HTR7
SCHEMBL5859330 0.76 SLC6A4 (0.34) DRD2SLC6A4HTR7
SCHEMBL7597618 0.76 HTR7 (0.31) DRD2SLC6A4HTR7
SCHEMBL7602104 0.76 GAA (0.31)
SCHEMBL27559648 0.75 SLC6A4 (0.33) DRD2SLC6A4HTR7
SCHEMBL8613248 0.75 SLC6A4 (0.34) DRD2SLC6A4HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6410665-B1 POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN BASELL POLYOLEFINE GMBH (DE) 2002-06-25 US claimed
US-6410665-B1 POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN BASELL POLYOLEFINE GMBH (DE) 2002-06-25 US disclosed