SCHEMBL7604159

SCHEMBL7604159

CC(Cc1cccc2c1Cc1ccccc1-2)c1cccc2c1Cc1ccccc1-2.[Zr]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.54
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
ALDH1A1 P00352 2/20 0.33
EGFR P00533 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CHRM2 P08172 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
SCHEMBL1539790 0.98 PNMT (0.55) PNMTDRD2DRD4DRD3NPC1
Hydrochloric Acid SCHEMBL7607175 0.96 PNMT (0.53) PNMTDRD2DRD4DRD3NPC1
SCHEMBL7603809 0.84 PNMT (0.55) PNMTDRD2DRD4DRD3NPC1
SCHEMBL27686579 0.83 PNMT (0.62) PNMTDRD2DRD4DRD3NPC1
SCHEMBL27525074 0.81 PNMT (0.49) PNMTDRD2DRD4DRD3NPC1
SCHEMBL6557933 0.81 PNMT (0.55) PNMTDRD2DRD4DRD3NPC1
SCHEMBL7609044 0.81 PNMT (0.59) PNMTDRD2DRD4DRD3NPC1
SCHEMBL9580014 0.80 PNMT (0.46) PNMTDRD2DRD4DRD3NPC1
SCHEMBL7939785 0.80 PNMT (0.58) PNMTDRD2DRD4DRD3NPC1
Hydrochloric Acid SCHEMBL7606880 0.79 PNMT (0.45) PNMTDRD2DRD4DRD3NPC1

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
EP-0524624-B1 Use of organometallic flurorenyl compounds. PHILLIPS PETROLEUM CO (US) 2002-05-15 EP claimed