SCHEMBL2968026

SCHEMBL2968026

CCCCc1ccccc1C1=CC(C)c2ccc(Br)cc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.35
MAPK1 P28482 1/20 0.35
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
NPC1 O15118 1/20 0.32
GAA P10253 1/20 0.32
NFKB1 P19838 1/20 0.32
RAB9A P51151 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
TYR P14679 1/20 0.31
CNR2 P34972 1/20 0.31
MC4R P32245 5/20 0.31
LIPG Q9Y5X9 1/20 0.31
EDNRB P24530 1/20 0.30
EDNRA P25101 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
SCHEMBL2970025 0.90 TP53 (0.35) LMNATP53MAPTNPC1GAA
SCHEMBL2958513 0.80 BCHE (0.33) NR1H2NR1H3LIPGBCHEACHE
SCHEMBL2968029 0.79 NPC1 (0.42) MAPK1LMNATP53MAPTNPC1
SCHEMBL2972368 0.79 NR1H2 (0.33) NR1H2NR1H3CNR2LIPG
SCHEMBL2973762 0.74 MAPK1 (0.40) CYP1A2MAPK1LMNATP53MAPT
SCHEMBL2970966 0.74 CYP1A2 (0.39) CYP1A2MAPK1GAASMN1; SMN2CNR2
SCHEMBL2974120 0.73 MC4R (0.32) CYP1A2MAPK1LMNATP53MAPT
SCHEMBL2973694 0.72 CYP1A2 (0.35) CYP1A2MAPK1LMNATP53MAPT
SCHEMBL2971771 0.71 CYSLTR2 (0.33) LMNATP53MAPTNR1H2NR1H3
SCHEMBL2969378 0.71 TP53 (0.34) LMNATP53MAPTNPC1GAA

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 2 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

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 CYP1A2 2409/4885MAPK1 3118/4885LMNA 2058/4885

“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.