SCHEMBL7589683

SCHEMBL7589683

CCCCCO[Zr](Cc1ccccc1)(Cc1ccccc1)OCCCCC

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.44
KCNH2 Q12809 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
TP53 P04637 2/20 0.40
TSHR P16473 2/20 0.40
MAPK1 P28482 2/20 0.40
DNM1 Q05193 2/20 0.40
CYP3A4 P08684 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
EPHX2 P34913 1/20 0.39
PKM P14618 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
CETP P11597 1/20 0.38

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
SCHEMBL6911569 0.94 LTA4H (0.44) LTA4HKCNH2SIGMAR1TP53TSHR
SCHEMBL6909881 0.86 TP53 (0.41) LTA4HKCNH2TP53TSHRMAPK1
SCHEMBL7593920 0.85 LTA4H (0.44) LTA4HSIGMAR1TP53TSHRMAPK1
SCHEMBL7596224 0.85 LTA4H (0.44) LTA4HKCNH2SIGMAR1TP53TSHR
SCHEMBL6911174 0.79 LTA4H (0.44) LTA4HKCNH2SIGMAR1TP53TSHR
SCHEMBL6913978 0.79 LTA4H (0.44) LTA4HSIGMAR1TP53TSHRMAPK1
SCHEMBL6913855 0.78 TP53 (0.44) LTA4HKCNH2TP53TSHRALDH1A1
SCHEMBL7589689 0.76 CETP (0.44) LTA4HSIGMAR1TP53TSHRMAPK1
SCHEMBL7596230 0.76 CETP (0.44) LTA4HSIGMAR1TP53TSHRMAPK1
SCHEMBL941253 0.71 TSHR (0.56) LTA4HSIGMAR1TSHRMAPK1CYP3A4

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0694563-B1 Olefin polymerization catalyst and process for preparing polyolefins NIPPON MITSUBISHI OIL CORP (JP) 2002-10-30 EP disclosed
US-6111040-A Process for the production of olefinic polymers NIPPON MITSUBISHI OIL CORPORATION (JP) 2000-08-29 US disclosed
US-6077804-A Olefin polymerization catalyst and process for preparing polyolefins NIPPON OIL COMPANY, LIMITED (JP) 2000-06-20 US disclosed
EP-0679662-B1 Catalyst component for the polymerization of olefins NIPPON OIL CO LTD (JP) 1999-07-14 EP disclosed
US-5780562-A GROUP 4 METAL ALKOXIDE DERIVATIVES COMPLEXED WITH GROUP 1-3 METAL ALKOXIDE DERIVATIVES, ORGANOCYCLIC COMPOUNDS HAVING CONJUGATED BONDS, ALUMOXANES, AND A SLILICA OR ALUMINA NIPPON OIL CO., LTD. (JP) 1998-07-14 US disclosed
US-5728641-A Catalyst component for the polymerization of olefins NIPPON OIL COMPANY, LIMITED (JP) 1998-03-17 US disclosed
EP-0694563-A1 Olefin polymerization catalyst and process for preparing polyolefins NIPPON OIL COMPANY, LIMITED (JP) 1996-01-31 EP disclosed
EP-0679662-A1 Catalyst component for the polymerization of olefins NIPPON OIL CO. LTD. (JP) 1995-11-02 EP disclosed