SCHEMBL2970945

SCHEMBL2970945

CCCCc1ccccc1C1C(C)=Cc2cc(Br)ccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.35
LMNA P02545 3/20 0.35
MAPT P10636 2/20 0.35
CYSLTR2 Q9NS75 2/20 0.34
CYSLTR1 Q9Y271 2/20 0.34
TLR8 Q9NR97 1/20 0.33
SLC6A2 P23975 2/20 0.32
HTR2A P28223 2/20 0.32
HTR2C P28335 2/20 0.32
SLC6A4 P31645 2/20 0.32
ALOX5 P09917 1/20 0.31
PTGS2 P35354 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
SKP2 Q13309 1/20 0.31
POLB P06746 1/20 0.30
DRD2 P14416 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 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
SCHEMBL2961224 0.90 TP53 (0.35) TP53LMNAMAPTCYSLTR2CYSLTR1
SCHEMBL2959851 0.80 CYSLTR2 (0.34) CYSLTR2CYSLTR1TLR8LIPG
SCHEMBL2960663 0.79 CYSLTR2 (0.35) CYSLTR2CYSLTR1TLR8LIPG
SCHEMBL2970949 0.78 SKP2 (0.40) HTR2ASKP2NPC1HTTRAB9A
SCHEMBL2975457 0.78 MAPK1 (0.35) TP53LMNAMAPTSLC6A2HTR2A
SCHEMBL2962848 0.74 KDM1A (0.38) MAPTSLC6A2HTR2AHTR2CSLC6A4
SCHEMBL2973079 0.74 HTR2C (0.38) SLC6A2HTR2AHTR2CSLC6A4
SCHEMBL2971669 0.73 HDAC4 (0.36) LMNASLC6A2HTR2AHTR2CSLC6A4
SCHEMBL2973694 0.72 CYP1A2 (0.35) TP53LMNAMAPTCYSLTR2CYSLTR1
SCHEMBL2962539 0.69 TP53 (0.35) TP53LMNAMAPTCYSLTR2CYSLTR1

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 TP53 4276/4885LMNA 2058/4885MAPT 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.