SCHEMBL2961808

SCHEMBL2961808

CCCCc1ccccc1C1=Cc2c(Br)cccc2C1C

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
CYSLTR2 Q9NS75 2/20 0.32
CYSLTR1 Q9Y271 2/20 0.32
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
EGFR P00533 2/20 0.31
ERBB2 P04626 1/20 0.31
LIPG Q9Y5X9 1/20 0.31

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
SCHEMBL2962624 0.80 NR1H2 (0.34) NR1H2NR1H3EGFRERBB2LIPG
SCHEMBL2974120 0.79 MC4R (0.32) NR1H2NR1H3LIPG
SCHEMBL2969378 0.76 TP53 (0.34) NR1H2NR1H3LIPG
SCHEMBL2960663 0.74 CYSLTR2 (0.35) CYSLTR2CYSLTR1LIPG
SCHEMBL9277000 0.74 LIPG (0.43) NR1H2NR1H3LIPG
SCHEMBL2958513 0.72 BCHE (0.33) BCHEACHECYSLTR2CYSLTR1NR1H2
SCHEMBL2973975 0.71 ALDH1A1 (0.35)
SCHEMBL2972368 0.68 NR1H2 (0.33) NR1H2NR1H3LIPG
SCHEMBL2971782 0.68 CYSLTR2 (0.31) CYSLTR2CYSLTR1NR1H2NR1H3LIPG
SCHEMBL4450889 0.68 TAAR1 (0.56) LIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7763562-B2 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-07-27 US disclosed
US-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2007-06-14 US disclosed
WO-2006065809-A2 HETEROATOM BRIDGED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-06-22 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 (1 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-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization AP2M1, AP1M1, PYM1 BCHE 4431/4885ACHE 2031/4885CYSLTR2 1369/4885

“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.