SCHEMBL2966003

SCHEMBL2966003

CC1=C(c2c(C)cc(C)cc2C)c2cccc(Br)c2C1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.33
CSNK1A1 P48729 1/20 0.33
CDK5 Q00535 1/20 0.33
ROCK1 Q13464 1/20 0.33
DYRK1A Q13627 1/20 0.33
LRRK2 Q5S007 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
DYRK1B Q9Y463 1/20 0.33
TYR P14679 1/20 0.32
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
PARP10 Q53GL7 1/20 0.31
PARP11 Q9NR21 1/20 0.31
RAPGEF4 Q8WZA2 1/20 0.31
PDK2 Q15119 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL2969601 0.78 NPC1 (0.40) PIM1CSNK1A1CDK5ROCK1DYRK1A
SCHEMBL2973423 0.78 ALDH1A1 (0.36) PIM1CSNK1A1CDK5ROCK1DYRK1A
SCHEMBL2967198 0.76 RAPGEF4 (0.32) RAPGEF4ALDH1A1
SCHEMBL2972021 0.76 ALDH1A1 (0.44) PIM1CSNK1A1CDK5ROCK1DYRK1A
SCHEMBL2966449 0.75 ALDH1A1 (0.39) PIM1CSNK1A1CDK5ROCK1DYRK1A
SCHEMBL2973226 0.72 PIM1 (0.40) PIM1CSNK1A1CDK5ROCK1DYRK1A
SCHEMBL2963720 0.72 ALDH1A1 (0.36) PIM1CSNK1A1CDK5ROCK1DYRK1A
SCHEMBL28600277 0.70 ALDH1A1 (0.46) MAOAMAOBRAPGEF4PDK2ALDH1A1
SCHEMBL2963682 0.70 CHEK2 (0.36) PARP10RAPGEF4ALDH1A1
SCHEMBL2965972 0.70 METAP1 (0.39) PARP10PARP11RAPGEF4ALDH1A1

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 PIM1 4466/4885CSNK1A1 4303/4885CDK5 2133/4885

“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.