SCHEMBL2961927

SCHEMBL2961927

Brc1ccc2sc3c(c2c1)C=CC3

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPM2A O95278 1/20 0.34
PTPN2 P17706 1/20 0.34
PTPN1 P18031 1/20 0.34
PTPN22 Q9Y2R2 1/20 0.34
CYP2A6 P11509 2/20 0.33
HRH4 Q9H3N8 1/20 0.31
HSP90AA1 P07900 1/20 0.30
IDO1 P14902 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
SCHEMBL2974328 0.86 HRH4 (0.33) HRH4
SCHEMBL23302722 0.74 GPR3 (0.44) IDO1
SCHEMBL25946291 0.73 EPM2A (0.31) EPM2APTPN2PTPN1PTPN22HRH4
SCHEMBL216673 0.70 EPM2A (0.53) EPM2APTPN2PTPN1PTPN22CYP2A6
SCHEMBL16453018 0.69 PIM3 (0.34)
SCHEMBL15781405 0.69 ACHE (0.40)
SCHEMBL23676521 0.69 ALDH1A1 (0.34)
SCHEMBL12811607 0.66 EPM2A (0.50) EPM2APTPN2PTPN1PTPN22CYP2A6
SCHEMBL9949673 0.66 CYP2A6 (0.42) EPM2APTPN2PTPN1PTPN22CYP2A6
SCHEMBL18457498 0.66 PIM3 (0.45)

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 EPM2A 3903/4885PTPN2 3990/4885PTPN1 4091/4885

“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.