SCHEMBL2959658

SCHEMBL2959658

CC1=CC(c2cccc(C)c2C)c2cccc(Br)c21

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 2/20 0.38
HTR2C P28335 3/20 0.37
ALDH1A1 P00352 1/20 0.36
HTR2A P28223 1/20 0.34
HTR2B P41595 1/20 0.34
TRPA1 O75762 1/20 0.31
ATM Q13315 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
SCHEMBL2960706 0.88 PBRM1 (0.46) PBRM1HTR2CALDH1A1HTR2AHTR2B
SCHEMBL2973832 0.78 GID4 (0.37) PBRM1ALDH1A1
SCHEMBL2975128 0.78 PBRM1 (0.34) PBRM1ALDH1A1
SCHEMBL2959986 0.78 KDM1A (0.37) PBRM1ALDH1A1
SCHEMBL2960702 0.77 PBRM1 (0.33) PBRM1ALDH1A1
SCHEMBL2967043 0.74 MAPK1 (0.37) HTR2CALDH1A1HTR2AHTR2B
SCHEMBL2964518 0.73 HTR2C (0.34) HTR2CALDH1A1HTR2AHTR2B
SCHEMBL2970600 0.73 PBRM1 (0.36) PBRM1ALDH1A1
SCHEMBL2969029 0.72 CYSLTR2 (0.35) PBRM1
SCHEMBL2965300 0.71 KDM4E (0.36) PBRM1HTR2CHTR2B

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 PBRM1 618/4885HTR2C 2725/4885ALDH1A1 4332/4885

“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.