SCHEMBL2958036

SCHEMBL2958036

CC1=Cc2cccc(Br)c2C1c1ccccc1C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
PBRM1 Q86U86 1/20 0.38
HTR2C P28335 3/20 0.32
HTR2A P28223 1/20 0.32
HTR2B P41595 1/20 0.32
KDM1A O60341 2/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GAA P10253 1/20 0.31
TSHR P16473 1/20 0.31
HDAC4 P56524 1/20 0.31
TAAR1 Q96RJ0 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
SCHEMBL2964138 0.89 HTR2C (0.36) ALDH1A1PBRM1HTR2CHTR2AHTR2B
SCHEMBL2962492 0.83 KDM1A (0.38) ALDH1A1KDM1AMAPTGAATSHR
SCHEMBL2972357 0.80 ALDH1A1 (0.33) ALDH1A1GAAHDAC4
SCHEMBL2959851 0.78 CYSLTR2 (0.34) KDM1ATAAR1
SCHEMBL2974273 0.77 RAPGEF4 (0.32) ALDH1A1
SCHEMBL2958035 0.77 MEN1 (0.37) ALDH1A1MAPTHDAC4
SCHEMBL2969448 0.77 ALDH1A1 (0.42) ALDH1A1PBRM1HTR2CHTR2AHTR2B
SCHEMBL2975457 0.74 MAPK1 (0.35) ALDH1A1PBRM1HTR2CHTR2AHTR2B
SCHEMBL21213977 0.74 KDM1A (0.40) ALDH1A1HTR2CHTR2AHTR2BKDM1A
SCHEMBL2969603 0.73 PBRM1 (0.39) ALDH1A1PBRM1HTR2CHTR2AHTR2B

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

“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.