SCHEMBL8896107

SCHEMBL8896107

C[Zr](C)(=C(c1ccccc1)c1ccccc1)c1c(C2=CC=CC2)ccc2c1Cc1ccccc1-2

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 2/20 0.35
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PGR P06401 1/20 0.32
PNMT P11086 1/20 0.31
SRD5A1 P18405 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
SCHEMBL1922809 0.86 NPC1 (0.37) SRD5A2NPC1RAB9APGRPNMT
SCHEMBL6837572 0.81 PGR (0.35) SRD5A2NPC1RAB9APGRPNMT
Hydrochloric Acid SCHEMBL618234 0.80 PGR (0.34) SRD5A2NPC1RAB9APGRPNMT
SCHEMBL8897776 0.80 NPC1 (0.36) SRD5A2NPC1RAB9APGRPNMT
Hydrochloric Acid SCHEMBL6907081 0.78 PGR (0.33) SRD5A2NPC1RAB9APGRPNMT
SCHEMBL28220071 0.76 PNMT (0.44) SRD5A2NPC1RAB9APGRPNMT
SCHEMBL8896051 0.76 NPC1 (0.33) SRD5A2NPC1RAB9APGRPNMT
Hydrochloric Acid SCHEMBL27425148 0.75 PNMT (0.42) SRD5A2NPC1RAB9APGRPNMT
SCHEMBL7195348 0.75 SRD5A2 (0.36) SRD5A2NPC1RAB9APGRPNMT
SCHEMBL27348144 0.74 PNMT (0.45) SRD5A2NPC1RAB9APGRPNMT

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
EP-0619326-B1 Olefin polymerization catalyst and olefin polymerisation process TOSOH CORP (JP) 1997-06-25 EP disclosed
EP-0619326-A1 Olefin polymerization catalyst and olefin polymerisation process TOSOH CORPORATION (JP) 1994-10-12 EP disclosed