SCHEMBL5589555

SCHEMBL5589555

CCCCCCCCOc1c(C)c(C(=O)O)c(O)c(O)c1OCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.45
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
PLA2G4B P0C869 1/20 0.44
THRA P10827 4/20 0.43
THRB P10828 4/20 0.43
PSEN1 P49768 3/20 0.43
RARB P10826 3/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ESR1 P03372 1/20 0.42

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
SCHEMBL5588524 1.00 PLA2G2A (0.45) PLA2G2ATP53TSHRPLA2G4BTHRA
SCHEMBL5588700 1.00 PLA2G2A (0.45) PLA2G2ATP53TSHRPLA2G4BTHRA
SCHEMBL5590606 1.00 PLA2G2A (0.45) PLA2G2ATP53TSHRPLA2G4BTHRA
SCHEMBL5590094 1.00 PLA2G2A (0.45) PLA2G2ATP53TSHRPLA2G4BTHRA
SCHEMBL5589802 0.94 THRA (0.41) PLA2G2ATP53TSHRPLA2G4BTHRA
SCHEMBL5589795 0.91 PSEN1 (0.46) PLA2G2ATP53TSHRPLA2G4BTHRA
SCHEMBL5590556 0.88 PLA2G2A (0.47) PLA2G2ATP53TSHRPLA2G4BTHRA
SCHEMBL5589140 0.88 PLA2G2A (0.47) PLA2G2ATP53TSHRPLA2G4BTHRA
SCHEMBL5590496 0.88 PLA2G2A (0.47) PLA2G2ATP53TSHRPLA2G4BTHRA
SCHEMBL5589978 0.88 PLA2G2A (0.47) PLA2G2ATP53TSHRPLA2G4BTHRA

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 PLA2G2A 4233/4885TP53 3753/4885TSHR 4680/4885

“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.