SCHEMBL2967448

SCHEMBL2967448

CCCCCCCCC1=CCc2c(Br)cccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.40
CNR1 P21554 3/20 0.38
KCNH2 Q12809 2/20 0.38
GPR84 Q9NQS5 1/20 0.33
GPR3 P46089 1/20 0.33
RECQL P46063 1/20 0.33
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
LIPG Q9Y5X9 2/20 0.32
LPL P06858 1/20 0.32
PIM1 P11309 1/20 0.32
CSNK1A1 P48729 1/20 0.32
CDK5 Q00535 1/20 0.32
ROCK1 Q13464 1/20 0.32
DYRK1A Q13627 1/20 0.32
LRRK2 Q5S007 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
DYRK1B Q9Y463 1/20 0.32
ACHE P22303 1/20 0.32
BACE1 P56817 1/20 0.32

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
SCHEMBL2969701 1.00 PTPN1 (0.40) PTPN1CNR1KCNH2GPR84GPR3
SCHEMBL2974062 1.00 PTPN1 (0.40) PTPN1CNR1KCNH2GPR84GPR3
SCHEMBL2972158 1.00 PTPN1 (0.40) PTPN1CNR1KCNH2GPR84GPR3
SCHEMBL2959826 1.00 PTPN1 (0.40) PTPN1CNR1KCNH2GPR84GPR3
SCHEMBL2969087 0.98 PTPN1 (0.38) PTPN1CNR1KCNH2GPR84GPR3
SCHEMBL2971821 0.94 PIM1 (0.33) PTPN1CNR1PIM1CSNK1A1CDK5
SCHEMBL2962759 0.87 PIM1 (0.35) PIM1CSNK1A1CDK5ROCK1DYRK1A
SCHEMBL2962733 0.80 PIM1 (0.37) PIM1CSNK1A1CDK5ROCK1DYRK1A
SCHEMBL9502276 0.78 PIM1 (0.35) PIM1CSNK1A1CDK5ROCK1DYRK1A
SCHEMBL2974667 0.76 KCNH2 (0.38) PTPN1CNR1KCNH2GPR84RECQL

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 2 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

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 PTPN1 4091/4885CNR1 3262/4885KCNH2 3320/4885

“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.