SCHEMBL4359045

SCHEMBL4359045

Cc1cccc2[nH]c(Cc3nc4c(C)cccc4[nH]3)nc12

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MGAM O43451 12/20 0.51
GAA P10253 12/20 0.51
SI P14410 12/20 0.51
MGAM2 Q2M2H8 12/20 0.51
ALDH1A1 P00352 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ESR1 P03372 1/20 0.49
CBFB Q13951 1/20 0.49
HTR6 P50406 1/20 0.47

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
SCHEMBL6999051 0.90 CHEK1 (0.56) MGAMGAASIMGAM2ALDH1A1
SCHEMBL6542830 0.90 GAA (0.60) MGAMGAASIMGAM2ALDH1A1
Hydrochloric Acid SCHEMBL7002030 0.89 CHEK1 (0.54) MGAMGAASIMGAM2ALDH1A1
SCHEMBL30518181 0.87 DDAH1 (0.55) MGAMGAASIMGAM2ALDH1A1
SCHEMBL4919548 0.87 DDAH1 (0.55) MGAMGAASIMGAM2ALDH1A1
SCHEMBL8328058 0.86 PKM (0.57) MGAMGAASIMGAM2ALDH1A1
SCHEMBL7461041 0.85 MGAM (0.55) MGAMGAASIMGAM2ALDH1A1
SCHEMBL4346855 0.85 MGAM (0.51) MGAMGAASIMGAM2ALDH1A1
SCHEMBL4062820 0.85 MGAM (0.51) MGAMGAASIMGAM2ALDH1A1
SCHEMBL7409334 0.85 MGAM (0.49) MGAMGAASIMGAM2ALDH1A1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7498390-B2 Chromium complexes and their use in olefin polymerization EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2009-03-03 US disclosed
US-7498287-B2 Chromium complexes and their use in olefin polymerization EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2009-03-03 US disclosed
US-20080071090-A1 Chromium complexes and their use in olefin polymerization KACKER SMITA 2008-03-20 US disclosed
US-20080021181-A1 Chromium complexes and their use in olefin polymerization KACKER SMITA 2008-01-24 US disclosed
US-7297805-B2 Chromium complexes and their use in olefin polymerization EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2007-11-20 US disclosed
EP-1789425-A2 CHROMIUM COMPLEXES AND THEIR USE IN OLEFIN POLYMERIZATION ExxonMobil Research and Engineering Company (US) 2007-05-30 EP disclosed
WO-2006012327-A2 CHROMIUM COMPLEXES AND THEIR USE IN OLEFIN POLYMERIZATION EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2006-02-02 WO disclosed
US-20050288464-A1 Chromium complexes and their use in olefin polymerization EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2005-12-29 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 (2 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-20050288464-A1 Chromium complexes and their use in olefin polymerization CBR3, CDYL, CCRL2 MGAM 4065/4885GAA 4618/4885SI 4577/4885
US-20080071090-A1 Chromium complexes and their use in olefin polymerization CBR3, CDYL, CCRL2 MGAM 4065/4885GAA 4618/4885SI 4577/4885

“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.