SCHEMBL5586703

SCHEMBL5586703

CCCCCCOc1c(CCCC)c(CCCC)c(O)c(O)c1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LDHA P00338 2/20 0.43
LDHB P07195 2/20 0.43
PLA2G2A P14555 1/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
THRA P10827 2/20 0.43
THRB P10828 2/20 0.43
PLA2G4B P0C869 1/20 0.42
BID P55957 3/20 0.40
MCL1 Q07820 3/20 0.40
RARB P10826 3/20 0.40
BCL2L1 Q07817 2/20 0.40
BAK1 Q16611 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ESR1 P03372 1/20 0.40
KAT8 Q9H7Z6 1/20 0.40

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
SCHEMBL5588468 1.00 LDHA (0.43) LDHALDHBPLA2G2ATP53TSHR
SCHEMBL5588105 1.00 LDHA (0.43) LDHALDHBPLA2G2ATP53TSHR
SCHEMBL5588290 1.00 LDHA (0.43) LDHALDHBPLA2G2ATP53TSHR
SCHEMBL5586672 0.99 LDHA (0.44) LDHALDHBPLA2G2ATP53TSHR
SCHEMBL5586675 0.97 BID (0.43) LDHALDHBPLA2G2ATP53TSHR
SCHEMBL5586979 0.97 BID (0.43) LDHALDHBPLA2G2ATP53TSHR
SCHEMBL5590227 0.97 BID (0.43) LDHALDHBPLA2G2ATP53TSHR
SCHEMBL5589184 0.97 BID (0.43) LDHALDHBPLA2G2ATP53TSHR
SCHEMBL5588650 0.97 BID (0.43) LDHALDHBPLA2G2ATP53TSHR
SCHEMBL5589894 0.97 BID (0.43) LDHALDHBPLA2G2ATP53TSHR

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 LDHA 320/4885LDHB 486/4885PLA2G2A 4233/4885

“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.