SCHEMBL2965705

SCHEMBL2965705

Cc1cc(C)c(C2=Cc3cc(Br)ccc3C2)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.36
RAPGEF4 Q8WZA2 2/20 0.34
ADRA2A P08913 1/20 0.32
PNMT P11086 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
ALDH1A1 P00352 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP19A1 P11511 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
CMA1 P23946 1/20 0.30
AHR P35869 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
SCHEMBL2972467 0.87 RAPGEF4 (0.34) RAPGEF4ADRA2APNMTADRA2BADRA2C
SCHEMBL4269308 0.78 PTGS2 (0.46) ALDH1A1MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL2959416 0.73 TRPA1 (0.46) TRPA1ADRA2APNMTADRA2BADRA2C
SCHEMBL2974771 0.72 MEN1 (0.37) TRPA1ADRA2APNMTADRA2BADRA2C
SCHEMBL2973628 0.72 ALDH1A1 (0.38) TRPA1ADRA2APNMTADRA2BADRA2C
SCHEMBL2967620 0.71 TRPA1 (0.45) TRPA1PNMTALDH1A1CYP19A1CYP11B1
SCHEMBL2973643 0.70 RAPGEF4 (0.31) RAPGEF4ALDH1A1MEN1MAPTKMT2A
SCHEMBL2962318 0.70 TRPA1 (0.34) TRPA1RAPGEF4ALDH1A1MEN1MAPT
SCHEMBL2965972 0.68 METAP1 (0.39) RAPGEF4ADRA2APNMTADRA2BADRA2C
SCHEMBL2963682 0.68 CHEK2 (0.36) RAPGEF4ADRA2APNMTADRA2BADRA2C

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 TRPA1 438/4885RAPGEF4 1250/4885ADRA2A 2587/4885

“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.