SCHEMBL627089

SCHEMBL627089

CC1=C(C)C(C)(C)C([Ti](Cl)(Oc2ccccc2-c2ccc3c(c2)C(C)(C)c2ccccc2-3)Oc2ccccc2-c2ccc3c(c2)C(C)(C)c2ccccc2-3)=C1C

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 4/20 0.38
PTPRC P08575 1/20 0.30
PTPN1 P18031 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
SCHEMBL626368 0.91 PDK2 (0.38) PDK2PTPRCPTPN1
SCHEMBL1629998 0.74 PDK2 (0.30) PDK2
SCHEMBL9999067 0.74 PDK2 (0.39) PDK2PTPRCPTPN1
SCHEMBL3803062 0.74 PDK2 (0.39) PDK2PTPRCPTPN1
SCHEMBL20081106 0.73 PDK2 (0.63) PDK2PTPRCPTPN1
SCHEMBL3676430 0.73 L3MBTL1 (0.35)
SCHEMBL3799195 0.72 PDK2 (0.48) PDK2PTPRCPTPN1
SCHEMBL30595509 0.71 PDK2 (0.46) PDK2
SCHEMBL3611287 0.70 HTR7 (0.35)
SCHEMBL2961760 0.69 PDK2 (0.45) PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8232359-B2 Process for preparing ethylene homopolymers or copolymers of ethylene with α-olefin by using the transition metal compound SK INNOVATION CO., LTD. (KR) 2012-07-31 US disclosed
US-20120041149-A1 ETHYLENE COPOLYMER AND A METHOD OF PREPARING THE SAME SK INNOVATION CO., LTD. (KR) 2012-02-16 US disclosed
US-20110319576-A1 PROCESS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE WITH ALPHA-OLEFIN BY USING THE TRANSITION METAL COMPOUND SK ENERGY CO., LTD. (KR) 2011-12-29 US disclosed
US-8067511-B2 Ethylene copolymer and a method of preparing the same SK INNOVATION CO., LTD. (KR) 2011-11-29 US disclosed
EP-2326654-A2 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND - OLEFINS USING THE SAME. SK Energy Co., Ltd. (KR) 2011-06-01 EP disclosed
US-20110098426-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF THE ETHYLENE AND a-OLEFINS USING THE SAME SK ENERGY CO., LTD. (KR) 2011-04-28 US disclosed
US-7928173-B2 Transition metal catalytic systems and methods for preparing ethylene homopolymers or copolymers of ethylene and α-olefins using the same SK ENERGY CO., LTD. (KR) 2011-04-19 US disclosed
US-20100120981-A1 ETHYLENE COPOLYMER AND A METHOD OF PREPARING THE SAME SABIC SK NEXLENE COMPANY PTE. LTD. (SG) 2010-05-13 US disclosed
US-20100081776-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND a-OLEFINS USING THE SAME SABIC SK NEXLENE COMPANY PTE. LTD. (SG) 2010-04-01 US disclosed
WO-2010036025-A2 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND α- OLEFINS USING THE SAME. SK ENERGY CO., LTD. (KR) 2010-04-01 WO 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 (2 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-20100081776-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND a-OLEFINS USING THE SAME ESR1, AOC3, PPOX PDK2 2895/4885PTPRC 3336/4885PTPN1 3907/4885
US-20110098426-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF THE ETHYLENE AND a-OLEFINS USING THE SAME ESR1, AOC3, AOC2 PDK2 3059/4885PTPRC 3212/4885PTPN1 4032/4885

“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.