SCHEMBL2970622

SCHEMBL2970622

Cc1ccc2c(Br)c(C3C=Cc4ccccc43)ccc2c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.38
CYP2A6 P11509 4/20 0.35
TDP1 Q9NUW8 1/20 0.35
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SIRT2 Q8IXJ6 4/20 0.32

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
SCHEMBL2962765 0.90 CYP2A6 (0.39) CYP1A2CYP2A6TDP1GAA
SCHEMBL2959346 0.83 POLB (0.41) CYP1A2CYP2A6TDP1ALDH1A1HPGD
SCHEMBL2972910 0.83 SIRT2 (0.34) CYP1A2CYP2A6TDP1KDM4EALDH1A1
SCHEMBL2975047 0.81 CYP2A6 (0.32) CYP1A2CYP2A6TDP1
SCHEMBL2962488 0.81 CYP1A2 (0.32) CYP1A2CYP2A6TDP1
SCHEMBL2963349 0.80 CYP2A6 (0.40) CYP1A2CYP2A6TDP1
SCHEMBL2963690 0.80 CYP2A6 (0.40) CYP1A2CYP2A6TDP1
SCHEMBL2959656 0.80
SCHEMBL2971970 0.80
SCHEMBL2963823 0.79 CYP1A2 (0.38) CYP1A2CYP2A6ALDH1A1

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 CYP1A2 2409/4885CYP2A6 2465/4885TDP1 4183/4885

“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.