SCHEMBL7101707

SCHEMBL7101707

CC1=C(Cc2ccccc2)CC([Zr](C)(C)C2c3ccccc3-c3ccccc32)=C1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.31
PTPN1 P18031 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
SCHEMBL7107829 0.79 GPR3 (0.32)
SCHEMBL7101703 0.70 PNMT (0.36) MAPT
Hydrochloric Acid SCHEMBL7107646 0.68 MAPT (0.32) MAPT
Hydrochloric Acid SCHEMBL7943328 0.66 MAPT (0.30) MAPT
SCHEMBL7566618 0.63 MAPT (0.40) MAPT
SCHEMBL2352229 0.62 CALM1 (0.52) MAPT
SCHEMBL8755072 0.60 MAPT (0.43) MAPT
SCHEMBL7602124 0.59 GPR3 (0.46)
SCHEMBL24245339 0.58 CALM1 (0.34)
SCHEMBL8087900 0.58 TP53 (0.40) PTPN1

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