SCHEMBL2963036

SCHEMBL2963036

CCCCc1ccc(-c2ccc3c(c2Br)C(C)=CC3)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.38
RARB P10826 3/20 0.36
HSD11B1 P28845 2/20 0.36
EDNRB P24530 1/20 0.35
EDNRA P25101 1/20 0.35
RAB9A P51151 3/20 0.35
NPC1 O15118 2/20 0.35
NFKB1 P19838 2/20 0.35
NFKB2 Q00653 2/20 0.35
RELA Q04206 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPK1 P28482 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 1/20 0.35
SKP2 Q13309 1/20 0.34
MPL P40238 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
S1PR1 P21453 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL2970872 0.83 HSD11B1 (0.37) NISCHRARBHSD11B1RAB9ANPC1
SCHEMBL2975359 0.81 NISCH (0.40) NISCHRARBHSD11B1EDNRBEDNRA
SCHEMBL2974756 0.81 RAB9A (0.37) NISCHRARBHSD11B1EDNRBEDNRA
SCHEMBL2962737 0.80 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1MAPT
SCHEMBL2967509 0.79 RARB (0.36) NISCHRARBHSD11B1EDNRBEDNRA
SCHEMBL2972695 0.79 RARB (0.36) NISCHRARBHSD11B1EDNRBEDNRA
SCHEMBL2963883 0.77 ALDH1A1 (0.34) MAPK1ALDH1A1
SCHEMBL2959222 0.76 SKP2 (0.37) NISCHRARBHSD11B1EDNRBEDNRA
SCHEMBL2966345 0.76 SKP2 (0.37) NISCHRARBHSD11B1EDNRBEDNRA
SCHEMBL2973789 0.74 HSD11B1 (0.39) NISCHRARBHSD11B1EDNRBEDNRA

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 NISCH 3153/4885RARB 2436/4885HSD11B1 4377/4885

“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.