SCHEMBL5588348

SCHEMBL5588348

Cc1cccc(C)c1/N=C1\CC(C)O\C1=N\c1c(C)cccc1C

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.38
CREBBP Q92793 1/20 0.38
KDM4E B2RXH2 1/20 0.36
TSHR P16473 1/20 0.36
MAOA P21397 4/20 0.33
MAOB P27338 4/20 0.33
POLB P06746 1/20 0.33
POLL Q9UGP5 1/20 0.31
ACHE P22303 1/20 0.30
MEN1 O00255 1/20 0.30
HSP90AA1 P07900 1/20 0.30
KMT2A Q03164 1/20 0.30
ATM Q13315 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
SCHEMBL5587514 1.00 BRD4 (0.38) BRD4CREBBPKDM4ETSHRMAOA
SCHEMBL5589122 0.98 BRD4 (0.37) BRD4CREBBPKDM4ETSHRMAOA
SCHEMBL5587310 0.89 BRD4 (0.32) BRD4CREBBPKDM4ETSHR
SCHEMBL5587198 0.88 BRD4 (0.32) BRD4CREBBPKDM4ETSHR
SCHEMBL5587367 0.80 FAAH (0.32) TSHR
SCHEMBL5586869 0.78 FAAH (0.31) TSHR
SCHEMBL6430829 0.69 MEN1 (0.36) TSHRPOLBACHEMEN1HSP90AA1
SCHEMBL6430827 0.69 MEN1 (0.36) TSHRPOLBACHEMEN1HSP90AA1
SCHEMBL5587152 0.68 CA1 (0.31) POLBACHEMEN1HSP90AA1KMT2A
SCHEMBL5586587 0.67 CA1 (0.30) ACHEMEN1HSP90AA1KMT2AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7247687-B2 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-07-24 US disclosed
EP-1521758-B1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2006-05-24 EP disclosed
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. 2006-03-02 US disclosed
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP disclosed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 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-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization MLX, LOX, LMTK3 BRD4 2835/4885CREBBP 4709/4885KDM4E 1868/4885

“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.