SCHEMBL2967693

SCHEMBL2967693

CC1=CCc2c(Br)cc(-c3ccccc3)cc21

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
AKR1C4 P17516 1/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
AKR1C1 Q04828 1/20 0.36
ALDH1A1 P00352 3/20 0.34
MAPK1 P28482 2/20 0.34
HPRT1 P00492 1/20 0.33
PTGS1 P23219 1/20 0.33
PGR P06401 1/20 0.33
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAOB P27338 1/20 0.31
PTPN1 P18031 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
SCHEMBL2975044 0.79 CA12 (0.38) ALDH1A1
SCHEMBL2974952 0.78 S1PR1 (0.31) MAOB
SCHEMBL2966230 0.78 AKR1C3 (0.39) AKR1C3AKR1C2AKR1C1ALDH1A1MAPK1
SCHEMBL2974824 0.77 RARB (0.38) AKR1C2AKR1C1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL2974821 0.75 PPARA (0.31)
SCHEMBL2973661 0.74 ALDH1A1 (0.35) ALDH1A1
SCHEMBL2962692 0.73 ALDH1A1 (0.34) ALDH1A1MAPK1PTGS1
SCHEMBL2962460 0.73 CRHBP (0.43) CRHBPCRHR2AKR1C4AKR1C3AKR1C2
SCHEMBL2962632 0.72 ALDH1A1 (0.36) ALDH1A1MAPK1
SCHEMBL2972968 0.71 PIM1 (0.40) ALDH1A1MAPK1MAOB

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 CRHBP 2545/4885CRHR2 4141/4885AKR1C4 3132/4885

“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.