SCHEMBL5589327

SCHEMBL5589327

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.38
MEN1 O00255 1/20 0.38
HSP90AA1 P07900 1/20 0.38
KMT2A Q03164 1/20 0.38
POLB P06746 2/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2A6 P11509 1/20 0.35
ACHE P22303 4/20 0.33
GRIN1 Q05586 4/20 0.33
GRIN2A Q12879 4/20 0.33
ALDH1A1 P00352 2/20 0.33
ALOX12 P18054 2/20 0.33
MAPT P10636 2/20 0.33
GRIN2D O15399 2/20 0.33
GRIN3B O60391 2/20 0.33
GRIN2B Q13224 2/20 0.33
GRIN2C Q14957 2/20 0.33
GRIN3A Q8TCU5 2/20 0.33
SIGMAR1 Q99720 2/20 0.33
HPGD P15428 2/20 0.33

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
SCHEMBL5589333 1.00 ATM (0.38) ATMMEN1HSP90AA1KMT2APOLB
SCHEMBL5588692 0.98 MEN1 (0.36) ATMMEN1HSP90AA1KMT2APOLB
SCHEMBL5589646 0.86 GABRA1 (0.34) ATMMEN1HSP90AA1KMT2ACYP1A2
SCHEMBL5587350 0.84 GABRA1 (0.33) CYP1A2HPGDCA1CA2TSHR
SCHEMBL10965706 0.82 ATM (0.38) ATMMEN1HSP90AA1KMT2APOLB
SCHEMBL10806942 0.80 POLB (0.37) ATMMEN1HSP90AA1KMT2APOLB
SCHEMBL6257035 0.78 CNR2 (0.34)
SCHEMBL6257038 0.78 CNR2 (0.34)
SCHEMBL6430012 0.78 HPGD (0.35) ATMMEN1HSP90AA1KMT2AMAPT
SCHEMBL7238485 0.78 L3MBTL1 (0.50) MEN1KMT2ACYP2A6ALDH1A1ALOX12

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-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

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 ATM 3933/4885MEN1 3377/4885HSP90AA1 4349/4885

“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.