SCHEMBL2966321

SCHEMBL2966321

Brc1cc2c(c(-c3cccc4ccccc34)c1)CC=C2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
ALPL P05186 1/20 0.36
GAA P10253 1/20 0.36
HTR1A P08908 2/20 0.32
HTR7 P34969 2/20 0.32
NISCH Q9Y2I1 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALDH1A1 P00352 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
GPR84 Q9NQS5 1/20 0.31
TRPM2 O94759 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
CA12 O43570 1/20 0.30
CA9 Q16790 1/20 0.30
HPGD P15428 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
SCHEMBL6930009 0.81 HTR7 (0.39) KDM4EALPLGAAHTR1AHTR7
SCHEMBL29767585 0.81 HTR7 (0.39) KDM4EALPLGAAHTR1AHTR7
SCHEMBL2962525 0.78 CA12 (0.37) KDM4EALPLGAANISCHALDH1A1
SCHEMBL2971023 0.78 HTR1A (0.33) KDM4EALPLGAAHTR1AHTR7
SCHEMBL2970904 0.77 KDM4E (0.36) KDM4EALPLGAAHTR1AHTR7
SCHEMBL2959760 0.76 AKR1C3 (0.39) ALDH1A1ESR2MAPK1
SCHEMBL2973804 0.75 DHFR (0.36) KDM4EALPLGAANPSR1ALDH1A1
SCHEMBL2964525 0.75 DHFR (0.36) KDM4EALPLGAANPSR1ALDH1A1
SCHEMBL2973616 0.75 DHFR (0.36) KDM4EALPLGAANPSR1ALDH1A1
SCHEMBL2964211 0.73 GPR84 (0.33) KDM4EALPLGAAHTR1AHTR7

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 KDM4E 2177/4885ALPL 3270/4885GAA 4439/4885

“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.