SCHEMBL7591920

SCHEMBL7591920

CC(C)(CO[Zr](OCC(C)(C)c1ccccc1)(OCC(C)(C)c1ccccc1)OCC(C)(C)c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.50
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 2/20 0.40
ALOX15 P16050 1/20 0.40
TACR1 P25103 1/20 0.37
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
KCNN4 O15554 3/20 0.34
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34
CYP3A4 P08684 1/20 0.34
CES1 P23141 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL7597812 0.89 TAAR1 (0.41) TAAR1MAPK1ALDH1A1ALOX15TACR1
SCHEMBL7592564 0.89 TAAR1 (0.41) TAAR1MAPK1ALDH1A1ALOX15TACR1
SCHEMBL7597796 0.85 TAAR1 (0.48) TAAR1MAPK1ALDH1A1ALOX15TACR1
SCHEMBL7597784 0.83 TAAR1 (0.47) TAAR1MAPK1ALDH1A1ALOX15TACR1
SCHEMBL7596569 0.83 TAAR1 (0.47) TAAR1MAPK1ALDH1A1ALOX15TACR1
SCHEMBL7593651 0.83 TAAR1 (0.47) TAAR1MAPK1ALDH1A1ALOX15TACR1
SCHEMBL7592984 0.83 TAAR1 (0.47) TAAR1MAPK1ALDH1A1ALOX15TACR1
SCHEMBL7592729 0.83 TAAR1 (0.47) TAAR1MAPK1ALDH1A1ALOX15TACR1
SCHEMBL7596750 0.83 TAAR1 (0.47) TAAR1MAPK1ALDH1A1ALOX15TACR1
SCHEMBL7593989 0.83 TAAR1 (0.47) TAAR1MAPK1ALDH1A1ALOX15TACR1

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 12 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
EP-0745616-B1 Catalyst composition and process for the production of olefinic polymers NIPPON OIL CO LTD (JP) 1999-04-07 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-5750454-A Catalyst composition and process for the production of olefinic polymers NIPPON OIL CO., LTD. (JP) 1998-05-12 US disclosed
US-5728641-A Catalyst component for the polymerization of olefins NIPPON OIL COMPANY, LIMITED (JP) 1998-03-17 US disclosed
EP-0748823-A1 Catalyst composition and process for the production of olefinic polymers NIPPON OIL CO. LTD. (JP) 1996-12-18 EP disclosed
EP-0745616-A1 Catalyst composition and process for the production of olefinic polymers NIPPON OIL CO. LTD. (JP) 1996-12-04 EP 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