SCHEMBL2970307

SCHEMBL2970307

CC1=Cc2ccc(-c3cccc4ccccc34)c(Br)c2C1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.34
HTR1A P08908 2/20 0.34
CA12 O43570 3/20 0.33
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
CA9 Q16790 3/20 0.33
ALDH1A1 P00352 3/20 0.33
CYP2A6 P11509 1/20 0.33
BRD4 O60885 1/20 0.33
DHFR P00374 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
PTPN1 P18031 1/20 0.32
KDM4E B2RXH2 4/20 0.31
CYP1A2 P05177 2/20 0.31
CYP2C19 P33261 2/20 0.31
HPGD P15428 2/20 0.31
HTT P42858 1/20 0.31
CDK5 Q00535 1/20 0.31
CDK5R1 Q15078 1/20 0.31

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
SCHEMBL29776182 0.83 HTR7 (0.40) HTR7HTR1ACA12CA1CA2
SCHEMBL3155099 0.83 HTR7 (0.40) HTR7HTR1ACA12CA1CA2
SCHEMBL2961338 0.82 BRD4 (0.32) HTR7ALDH1A1BRD4SMN1; SMN2
SCHEMBL2963346 0.82 DHFR (0.38) HTR7HTR1ACA12CA1CA2
SCHEMBL2965281 0.79
SCHEMBL2970981 0.79 KDM4E (0.34) HTR7HTR1ACA12CA1CA2
SCHEMBL2964779 0.78 HTR7 (0.35) HTR7HTR1ACA12CA1CA2
SCHEMBL2971065 0.77 ALDH1A1 (0.34) ALDH1A1CYP2A6
SCHEMBL2963885 0.77 ALDH1A1 (0.37) HTR7HTR1ACA12CA1CA2
SCHEMBL2973386 0.77 CA12 (0.36) HTR7HTR1ACA12CA1CA2

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 HTR7 2417/4885HTR1A 2170/4885CA12 3150/4885

“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.