SCHEMBL7195348

SCHEMBL7195348

C1=CCC(c2ccc3c(c2[Zr]=C(c2ccccc2)c2ccccc2)Cc2ccccc2-3)=C1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 2/20 0.36
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PNMT P11086 1/20 0.31
SRD5A1 P18405 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
SCHEMBL698266 0.87 NPC1 (0.39) SRD5A2NPC1RAB9APNMTPGR
SCHEMBL3411856 0.83 SRD5A2 (0.33) SRD5A2
SCHEMBL9286137 0.80
SCHEMBL9286133 0.79
SCHEMBL3687435 0.79 PNMT (0.33) SRD5A2NPC1RAB9APNMTPGR
SCHEMBL6837569 0.79 PNMT (0.33) SRD5A2NPC1RAB9APNMTPGR
SCHEMBL2505648 0.79 PNMT (0.33) SRD5A2NPC1RAB9APNMTPGR
Hydrochloric Acid SCHEMBL7930876 0.78 NPC1 (0.32) SRD5A2NPC1RAB9APGR
Hydrochloric Acid SCHEMBL9069123 0.77 SRD5A2 (0.35) SRD5A2NPC1RAB9APNMTSRD5A1
SCHEMBL27348144 0.75 PNMT (0.45) SRD5A2NPC1RAB9APNMTPGR

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-0849286-B1 Improved polymer yield from supported metallocene catalysts FINA TECHNOLOGY (US) 2003-05-21 EP claimed
EP-0849286-A1 Improved polymer yield from supported metallocene catalysts FINA TECHNOLOGY, INC. (US) 1998-06-24 EP claimed