SCHEMBL2192146

SCHEMBL2192146

CC1=C([Zr+2](c2cccc3c2Cc2ccccc2-3)[SiH](C)C)CC=C1.[H-].[H-]

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
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
Hydrochloric Acid SCHEMBL5351419 0.83 PNMT (0.44) PNMTNPC1RAB9APGR
Fluoride Ion SCHEMBL1130432 0.83 PNMT (0.44) PNMTNPC1RAB9APGR
Hydrochloric Acid SCHEMBL650444 0.78 NPC1 (0.39) PNMTNPC1RAB9APGR
Hydrochloric Acid SCHEMBL3115118 0.78 PNMT (0.34) PNMTNPC1RAB9APGR
SCHEMBL2268057 0.78 PNMT (0.35) PNMTNPC1RAB9APGR
Hydrochloric Acid SCHEMBL6915300 0.75 PNMT (0.35) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL6554860 0.75 NPC1 (0.34) PNMTNPC1RAB9APGR
Fluoride Ion SCHEMBL1131088 0.75 PNMT (0.35) PNMTNPC1RAB9APGR
Hydrochloric Acid SCHEMBL218803 0.75 PNMT (0.35) PNMTNPC1RAB9APGR
Hydrochloric Acid SCHEMBL3388376 0.74 PNMT (0.35) PNMTNPC1RAB9APGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1181979-B1 Matrix of a catalytic component and a material comprising free olefin groups and process for polyolefin production ROHM & HAAS (US) 2011-07-13 EP disclosed
US-7332551-B2 Partially fluorinated naphthyl-based borates EXXONMOBIL CHEMICAL PATENTS INC. (US) 2008-02-19 US disclosed
US-7077977-B2 Bulky borate activations EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-07-18 US disclosed
US-7074736-B2 Hydrozirconated matrix and process for polyolefin production ROHM AND HAAS COMPANY (US) 2006-07-11 US disclosed
US-6909008-B2 Cocatalyst compositions EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-06-21 US disclosed
US-20050049436-A1 Partially fluorinated naphthyl-based borates EXXONMOBIL CHEMICAL PATENTS INC. 2005-03-03 US disclosed
US-20040254065-A1 Bulky borate activations EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-16 US disclosed
US-20040199021-A1 DICOPS CONTAINING ACETYLENIC SUBSTITUENTS EXXONMOBIL CHEMICAL PATENTS INC. 2004-10-07 US disclosed
US-20040152591-A1 Polymerized metallocene catalyst composition EXXONMOBIL CHEMICAL PATENTS, INC. 2004-08-05 US disclosed
US-20020052536-A1 Hydrozirconated matrix and process for polyolefin production ROHM AND HAAS COMPANY 2002-05-02 US disclosed
EP-1181979-A2 Matrix of a catalytic component and a material comprising free olefin groups and process for polyolefin production ROHM AND HAAS COMPANY (US) 2002-02-27 EP disclosed
US-6121395-A Ionic metallocene catalyst compositions EXXON CHEMICAL PATENTS INC. (US) 2000-09-19 US disclosed
US-5384299-A Ionic metallocene catalyst compositions EXXON CHEMICAL PATENTS INC. (US) 1995-01-24 US disclosed
US-5198401-A Ionic metallocene catalyst compositions EXXON CHEMICAL PATENTS INC. (US) 1993-03-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040199021-A1 DICOPS CONTAINING ACETYLENIC SUBSTITUENTS AADAC, NAA15, ALG8 PNMT 2261/4885NPC1 2597/4885RAB9A 3603/4885
US-20020052536-A1 Hydrozirconated matrix and process for polyolefin production HOGA1, PPIP5K2, HPD PNMT 868/4885NPC1 3687/4885RAB9A 4091/4885
US-20050049436-A1 Partially fluorinated naphthyl-based borates NBAS, TNK1, POF1B PNMT 1860/4885NPC1 1150/4885RAB9A 1952/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.