SCHEMBL2958359

SCHEMBL2958359

Brc1ccc2c(c1)C=CC2c1ccc2ccccc2c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.47
KDM4E B2RXH2 1/20 0.41
KDM1A O60341 3/20 0.36
RCOR1 Q9UKL0 2/20 0.36
EGFR P00533 2/20 0.35
ERBB2 P04626 2/20 0.35
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
SLC6A4 P31645 3/20 0.31
SLC6A2 P23975 2/20 0.31
SLC6A3 Q01959 2/20 0.31
CYP2D6 P10635 1/20 0.31
KCNH2 Q12809 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
REN P00797 1/20 0.30
CYP1A2 P05177 1/20 0.30
MAPK1 P28482 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
SCHEMBL2966222 0.88 CYP2A6 (0.47) CYP2A6KDM4EKDM1ARCOR1EGFR
SCHEMBL2964294 0.86 CYP2A6 (0.44) CYP2A6KDM4EKDM1ARCOR1EGFR
SCHEMBL2971420 0.85 CYP2A6 (0.43) CYP2A6KDM4EKDM1ARCOR1EGFR
SCHEMBL15814919 0.82 KDM4E (0.46) CYP2A6KDM4EKDM1AHTR2CHTR2B
SCHEMBL28025942 0.81 KDM4E (0.45) CYP2A6KDM4EKDM1AHTR2CHTR2B
SCHEMBL2973621 0.78 KDM4E (0.38) CYP2A6KDM4EHTR2CHTR2BSLC6A4
SCHEMBL2973809 0.78 KDM4E (0.38) CYP2A6KDM4EHTR2CHTR2BSLC6A4
SCHEMBL27999787 0.78 KDM4E (0.41) KDM4EKDM1AHTR2CHTR2BSLC6A4
SCHEMBL2971252 0.77 KDM1A (0.37) CYP2A6KDM1AEGFRERBB2HTR2C
SCHEMBL7849802 0.77 KDM4E (0.41) KDM4EKDM1AHTR2CHTR2BSLC6A4

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 CYP2A6 2465/4885KDM4E 2177/4885KDM1A 3280/4885

“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.