SCHEMBL7605895

SCHEMBL7605895

[Zr].c1ccc2c(c1)Cc1c(CCCc3cccc4c3Cc3ccccc3-4)cccc1-2

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.66
DRD2 P14416 3/20 0.47
DRD4 P21917 3/20 0.47
DRD3 P35462 3/20 0.47
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
HTR7 P34969 1/20 0.39
HTR2B P41595 1/20 0.39
MAOA P21397 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
BCHE P06276 2/20 0.34

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 SCHEMBL5353731 0.98 PNMT (0.64) PNMTDRD2DRD4DRD3NPC1
SCHEMBL6674911 0.98 PNMT (0.68) PNMTDRD2DRD4DRD3NPC1
SCHEMBL7604911 0.96 PNMT (0.66) PNMTDRD2DRD4DRD3NPC1
Hydrochloric Acid SCHEMBL5352652 0.95 PNMT (0.64) PNMTDRD2DRD4DRD3NPC1
Hydrochloric Acid SCHEMBL5353742 0.95 PNMT (0.64) PNMTDRD2DRD4DRD3NPC1
Hydrochloric Acid SCHEMBL5352665 0.95 PNMT (0.64) PNMTDRD2DRD4DRD3NPC1
SCHEMBL6675794 0.94 PNMT (0.68) PNMTDRD2DRD4DRD3NPC1
SCHEMBL6676505 0.93 PNMT (0.66) PNMTDRD2DRD4DRD3NPC1
SCHEMBL6674622 0.93 PNMT (0.66) PNMTDRD2DRD4DRD3NPC1
SCHEMBL6558685 0.92 PNMT (0.70) 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