SCHEMBL7101703

SCHEMBL7101703

CC1=C(Cc2ccccc2)CC([Zr](C)(C)c2cccc3c2Cc2ccccc2-3)=C1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.36
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MEN1 O00255 1/20 0.31
APAF1 O14727 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
PGR P06401 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
SCHEMBL7107827 0.82 NPC1 (0.40) PNMTNPC1RAB9APGR
SCHEMBL7602119 0.76 PNMT (0.49) PNMTNPC1RAB9AMEN1ALDH1A1
SCHEMBL30536713 0.76 PNMT (0.49) PNMTNPC1RAB9AMEN1ALDH1A1
Hydrochloric Acid SCHEMBL7107651 0.71 PNMT (0.36) PNMTNPC1RAB9AMEN1APAF1
SCHEMBL7078761 0.70 PNMT (0.39) PNMTNPC1RAB9APGR
SCHEMBL7101707 0.70 MAPT (0.31) MAPT
SCHEMBL7566617 0.69 PNMT (0.46) PNMTNPC1RAB9AMEN1APAF1
SCHEMBL8755070 0.69 PNMT (0.46) PNMTNPC1RAB9AMEN1APAF1
SCHEMBL8151881 0.67 PNMT (0.64) PNMTNPC1RAB9AMEN1APAF1
Hydrochloric Acid SCHEMBL7943324 0.67 PNMT (0.32) PNMTNPC1RAB9A

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-0786466-B1 Olefin polymerisation process which comprises a transition metal catalyst. TOSOH CORP (JP) 2003-04-16 EP disclosed