SCHEMBL2963096

SCHEMBL2963096

CC1=CC(c2ccccc2C)c2cc(Br)ccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
CYP1A2 P05177 1/20 0.35
MAPK1 P28482 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
PGR P06401 3/20 0.33
PTPRC P08575 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
ESR2 Q92731 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HTR2C P28335 6/20 0.31
HTR2A P28223 4/20 0.30
DRD2 P14416 2/20 0.30
PBRM1 Q86U86 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
ADRA2A P08913 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
SCHEMBL2964518 0.88 HTR2C (0.34) TP53POLBMAPTCYP1A2MAPK1
SCHEMBL2975585 0.87 MAPK1 (0.41) TP53POLBMAPTCYP1A2MAPK1
SCHEMBL2975608 0.82 MEN1 (0.36) TP53POLBMAPTCYP1A2MAPK1
SCHEMBL2956770 0.82 CYP1A2 (0.35) POLBMAPTCYP1A2MAPK1SLC6A2
SCHEMBL2962539 0.78 TP53 (0.35) TP53POLBMAPTSLC6A2SLC6A4
SCHEMBL2972321 0.77 RAPGEF4 (0.34) PGR
SCHEMBL2967043 0.76 MAPK1 (0.37) CYP1A2MAPK1ALDH1A1HTR2CHTR2A
SCHEMBL2963692 0.76 CYP2A6 (0.44) SLC6A2SLC6A4SLC6A3PGRHTR2C
SCHEMBL2963093 0.75 ALDH1A1 (0.39) MAPTMAPK1PGRALDH1A1
SCHEMBL2974937 0.72 PGR (0.40) CYP1A2MAPK1SLC6A2SLC6A4SLC6A3

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 TP53 4276/4885POLB 2658/4885MAPT 206/4885

“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.