SCHEMBL2961682

SCHEMBL2961682

CCCC1C(C)=Cc2cccc(Br)c21

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 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
SCHEMBL2970196 0.74 ALDH1A1 (0.33) ALDH1A1
SCHEMBL7783135 0.73 HTR2A (0.39) ALDH1A1CYP1A2CYP2C19
SCHEMBL2964138 0.72 HTR2C (0.36) ALDH1A1
SCHEMBL2974273 0.70 RAPGEF4 (0.32) ALDH1A1
SCHEMBL2958036 0.70 ALDH1A1 (0.39) ALDH1A1
SCHEMBL2958035 0.69 MEN1 (0.37) ALDH1A1
SCHEMBL2972357 0.69 ALDH1A1 (0.33) ALDH1A1
SCHEMBL1453984 0.68 KDM4E (0.33)
SCHEMBL2969603 0.66 PBRM1 (0.39) ALDH1A1
SCHEMBL1453017 0.65 HTR2A (0.32)

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 ALDH1A1 4332/4885CYP1A2 2409/4885CYP2C19 3738/4885

“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.