SCHEMBL2695757

SCHEMBL2695757

CCCCCCCCCCCCC[NH3+].Fc1c(F)c(F)c([B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.54
TSHR P16473 2/20 0.33
THRB P10828 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
Decylamine SCHEMBL25432939 1.00 DNM1 (0.54) DNM1TSHRTHRB
SCHEMBL3922022 1.00 DNM1 (0.54) DNM1TSHRTHRB
Dodecylamine SCHEMBL21176121 1.00 DNM1 (0.54) DNM1TSHRTHRB
Butylamine SCHEMBL392393 0.91 DNM1 (0.40) DNM1
Butylamine SCHEMBL7165869 0.91 DNM1 (0.40) DNM1
Butylamine SCHEMBL14836807 0.91 DNM1 (0.40) DNM1
Octane SCHEMBL29076189 0.89 TSHR (0.42) DNM1TSHRTHRB
Octane SCHEMBL23754699 0.87 TSHR (0.40) DNM1TSHRTHRB
Propylamine SCHEMBL5081968 0.84
SCHEMBL4581617 0.83 TSHR (0.36) TSHRTHRB

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 66 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115109099-A Transition metal compound, catalyst composition comprising the same, and ligand thereof LG化学株式会社 2022-09-27 CN disclosed
CN-110621681-B Novel transition metal compound and method for producing same LG化学株式会社 2022-07-29 CN disclosed
US-11225495-B2 Transition metal compound and method for preparing the same LG CHEM, LTD. 2022-01-18 US disclosed
EP-3611177-B1 NOVEL TRANSITION METAL COMPOUND AND METHOD FOR PREPARING SAME LG CHEMICAL LTD (KR) 2021-05-19 EP disclosed
US-20210032274-A1 Novel Transition Metal Compound and Method for Preparing the Same LG CHEM, LTD. (KR) 2021-02-04 US disclosed
EP-3219719-B1 TRANSITION METAL COMPOUND AND CATALYST COMPOSITION CONTAINING SAME LG CHEMICAL LTD (KR) 2020-12-23 EP disclosed
EP-3222622-B1 TRANSITION METAL COMPOUND AND CATALYST COMPOSITION CONTAINING SAME LG CHEMICAL LTD (KR) 2020-12-23 EP disclosed
US-10590215-B2 Transition metal compound and catalyst composition including the same LG CHEM, LTD. (KR) 2020-03-17 US disclosed
EP-3611177-A1 NOVEL TRANSITION METAL COMPOUND AND METHOD FOR PREPARING SAME LG Chem, Ltd. (KR) 2020-02-19 EP disclosed
US-10550204-B2 Transition metal compound and catalyst composition including the same LG CHEM, LTD. (KR) 2020-02-04 US disclosed
EP-2457894-B1 NOVEL POST METALLOCENE-TYPE TRANSITION METAL COMPOUND LG CHEMICAL LTD (KR) 2014-01-22 EP disclosed
US-20120259077-A1 MIXED METALLOCENE CATALYST COMPOSITION AND METHOD FOR PREPARING POLYOLEFIN USING THE SAME LG CHEM, LTD. (KR) 2012-10-11 US disclosed
US-20120196994-A1 NOVEL POST METALLOCENE-TYPE TRANSITION METAL COMPOUNDS LG CHEM, LTD. (KR) 2012-08-02 US disclosed
EP-2457894-A2 NOVEL POST METALLOCENE-TYPE TRANSITION METAL COMPOUND LG Chem, Ltd. (KR) 2012-05-30 EP disclosed
EP-2450384-A2 METHOD FOR PRODUCING AN ELASTOMER USING A TRANSITION METAL CATALYST LG Chem, Ltd. (KR) 2012-05-09 EP disclosed
US-20120108772-A1 METHOD FOR PRODUCING AN ELASTOMER USING A TRANSITION METAL CATALYST LG CHEM, LTD. (KR) 2012-05-03 US disclosed
US-7517940-B2 Catalyst composition including transition metal complexes and olefin polymerization using the same LG CHEM, LTD. (KR) 2009-04-14 US disclosed
WO-2007089112-A1 CATALYST COMPOSITION INCLUDING TRANSITION METAL COMPLEXES AND OLEFIN POLYMERIZATION USING THE SAME LG CHEM, LTD. (KR) 2007-08-09 WO disclosed
US-20070179046-A1 CATALYST COMPOSITION INCLUDING TRANSITION METAL COMPLEXES AND OLEFIN POLYMERIZATION USING THE SAME LG CHEM, LTD. (KR) 2007-08-02 US disclosed
US-6319979-B1 HAVING A DENSITY OF 0.850-0.895 G/CM.3 ; TACKIFYING RESIN; AND UP TO 40 WEIGHT PERCENT OF AT LEAST ONE WAX, VISCOSITY OF LESS THAN ABOUT 5000 CPS (50 GRAMS/(CM.SECOND)) AT 150 DEGREES C. THE DOW CHEMICAL COMPANY 2001-11-20 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 (5 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-10550204-B2 Transition metal compound and catalyst composition including the same ZCCHC8, ZNF436-AS1, ORC3 DNM1 77/4885TSHR 4836/4885THRB 4881/4885
US-20120196994-A1 NOVEL POST METALLOCENE-TYPE TRANSITION METAL COMPOUNDS ZC3HAV1L, ZKSCAN2, ZC3H18 DNM1 423/4885TSHR 4757/4885THRB 4847/4885
US-11225495-B2 Transition metal compound and method for preparing the same ODC1, TET1, MCM6 DNM1 348/4885TSHR 4846/4885THRB 4878/4885
US-20210032274-A1 Novel Transition Metal Compound and Method for Preparing the Same ODC1, MCM6, TET1 DNM1 866/4885TSHR 4825/4885THRB 4867/4885
US-10590215-B2 Transition metal compound and catalyst composition including the same SOD1, ZNF787, ALOX12 DNM1 94/4885TSHR 4822/4885THRB 4879/4885

“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.