SCHEMBL2970358

SCHEMBL2970358

BrC1=CCc2cnccc21

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.40
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36
CYP3A4 P08684 3/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP1 P29466 1/20 0.33
BLM P54132 1/20 0.33
CASP7 P55210 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CDC25B P30305 1/20 0.32
RPS6KA3 P51812 1/20 0.32
AXL P30530 1/20 0.31
PDE3B Q13370 1/20 0.30
PDE3A Q14432 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
SCHEMBL13496206 0.78 SIGMAR1 (0.40) SIGMAR1CHRNB2CHRNA4CYP3A4MAOA
SCHEMBL28332411 0.77 RPS6KA3 (0.39) SIGMAR1CHRNB2CHRNA4CYP3A4MAOA
SCHEMBL14048224 0.72 MPO (0.36) SIGMAR1CHRNB2CHRNA4
SCHEMBL14030317 0.72 SIGMAR1 (0.35) SIGMAR1CHRNB2CHRNA4CYP3A4TP53
SCHEMBL16369409 0.72 SIGMAR1 (0.35) SIGMAR1CHRNB2CHRNA4CYP3A4MAOA
SCHEMBL28211720 0.69 TP53 (0.31) CHRNB2CYP3A4MAOAMAOBTP53
SCHEMBL14452876 0.69 SIGMAR1 (0.48) SIGMAR1CHRNB2CHRNA4MAOAMAOB
SCHEMBL29699898 0.69 SIGMAR1 (0.48) SIGMAR1CHRNB2CHRNA4MAOAMAOB
SCHEMBL13496207 0.68 SIGMAR1 (0.43) SIGMAR1CHRNB2CHRNA4CYP3A4MAOA
SCHEMBL20816227 0.66 CCNC (0.44) SIGMAR1CYP3A4MAOAMAOBTP53

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 SIGMAR1 3249/4885CHRNB2 2042/4885CHRNA4 876/4885

“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.