SCHEMBL5589772

SCHEMBL5589772

Cc1cccc(C)c1N=C1C(=Nc2c(C(C)C)cccc2C(C)C)c2cccc3cccc1c23

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 4/20 0.34
TSHR P16473 3/20 0.34
MAPK1 P28482 2/20 0.34
HSD17B10 Q99714 2/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KCNN2 Q9H2S1 5/20 0.33
KCNN3 Q9UGI6 5/20 0.33
CYP3A4 P08684 2/20 0.33
CASP1 P29466 2/20 0.33
CASP7 P55210 2/20 0.33
PABPC1 P11940 1/20 0.33
DNMT1 P26358 1/20 0.33
LMNA P02545 3/20 0.32
HPGD P15428 2/20 0.32
HIF1A Q16665 2/20 0.32
FAAH O00519 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
SCHEMBL5589365 0.98 POLB (0.39) POLBMEN1KMT2AALDH1A1TSHR
SCHEMBL19625542 0.97 POLB (0.37) POLBMEN1KMT2AALDH1A1TSHR
SCHEMBL19625539 0.95 POLB (0.38) POLBMEN1KMT2AALDH1A1TSHR
SCHEMBL12923294 0.92 ALDH1A1 (0.40) MEN1KMT2AALDH1A1TSHRMAPK1
SCHEMBL987735 0.92 ALDH1A1 (0.40) MEN1KMT2AALDH1A1TSHRMAPK1
SCHEMBL5138932 0.92 ALDH1A1 (0.40) MEN1KMT2AALDH1A1TSHRMAPK1
SCHEMBL987736 0.92 ALDH1A1 (0.40) MEN1KMT2AALDH1A1TSHRMAPK1
SCHEMBL5587463 0.90 ALDH1A1 (0.39) MEN1KMT2AALDH1A1TSHRMAPK1
SCHEMBL21727826 0.90 LMNA (0.34) POLBMEN1KMT2AALDH1A1TSHR
SCHEMBL19625540 0.90 MEN1 (0.42) POLBMEN1KMT2AALDH1A1TSHR

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 POLB 1104/4885MEN1 3377/4885KMT2A 1733/4885

“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.