SCHEMBL816610

SCHEMBL816610

C=CCCCCCCCCCOC(=O)CC

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.62
ALDH1A1 P00352 3/20 0.52
LMNA P02545 2/20 0.52
LPAR3 Q9UBY5 2/20 0.47
LPAR2 Q9HBW0 1/20 0.47
HTT P42858 2/20 0.46
TSHR P16473 4/20 0.45
CYP3A4 P08684 3/20 0.45
FAAH O00519 2/20 0.44
MAPT P10636 3/20 0.44
ABCC4 O15439 1/20 0.44
USP2 O75604 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RECQL P46063 1/20 0.41
HPGD P15428 2/20 0.41
HCAR2 Q8TDS4 1/20 0.41
RAD52 P43351 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL873655 1.00 NAAA (0.62) NAAAALDH1A1LMNALPAR3LPAR2
SCHEMBL28310365 1.00 NAAA (0.62) NAAAALDH1A1LMNALPAR3LPAR2
SCHEMBL21986654 0.98 NAAA (0.59) NAAAALDH1A1LMNALPAR3LPAR2
SCHEMBL21986681 0.92 NAAA (0.55) NAAAALDH1A1LMNALPAR3LPAR2
SCHEMBL18481233 0.85 LMNA (0.53) NAAAALDH1A1LMNALPAR3LPAR2
SCHEMBL22832872 0.84 ALDH1A1 (0.55) NAAAALDH1A1LMNALPAR3LPAR2
SCHEMBL7702797 0.84 ALDH1A1 (0.55) NAAAALDH1A1LMNALPAR3LPAR2
SCHEMBL32674552 0.84 ALDH1A1 (0.55) NAAAALDH1A1LMNALPAR3LPAR2
SCHEMBL18319662 0.84 TSHR (0.57) NAAAALDH1A1LMNATSHRFAAH
SCHEMBL5176877 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170037282-A1 ADHESIVES COMPRISING (METH)ALLYL CROSSLINKER AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-02-09 US disclosed
EP-1960411-B1 HALOGEN SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2016-08-31 EP disclosed
US-9163046-B2 Process for producing substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2015-10-20 US disclosed
US-8877881-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2014-11-04 US disclosed
US-8557936-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-10-15 US disclosed
US-8546595-B2 Halogen substituted heteroatom-containing metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-10-01 US disclosed
US-8546501-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-10-01 US disclosed
US-8541522-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-09-24 US disclosed
US-8541521-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-09-24 US disclosed
US-8530593-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-09-10 US disclosed
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. 2006-03-02 US disclosed
WO-2006009942-A1 POLYMERIZATION PROCESS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-01-26 WO disclosed
WO-2006009980-A2 OLEFIN POLYMERISATION PROCESS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-01-26 WO disclosed
WO-2006009945-A1 IMPACT COPOLYMERS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-01-26 WO disclosed
WO-2006002132-A2 OLEFIN POLYMERIZATION PROCESS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-01-05 WO disclosed
WO-2005118605-A1 TRANSITION METAL COMPOUNDS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2005-12-15 WO disclosed
WO-2005095469-A1 CATALYST COMPOSITION AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-10-13 WO disclosed
US-20050209420-A1 Catalyst composition and use thereof EXXONMOBIL CHEMICAL PATENTS INC. 2005-09-22 US disclosed
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP disclosed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 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-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization MLX, LOX, LMTK3 NAAA 4040/4885ALDH1A1 2181/4885LMNA 178/4885
US-20050209420-A1 Catalyst composition and use thereof DGAT1, DGAT2, ALOX5 NAAA 941/4885ALDH1A1 2505/4885LMNA 4044/4885

“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.