SCHEMBL5587984

SCHEMBL5587984

CCCCOc1c(OCCCC)c(C(C)C)c(OC(=O)O)c(O)c1C(C)C

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRA P10827 3/20 0.38
THRB P10828 3/20 0.38
RXRA P19793 2/20 0.36
RARG P13631 1/20 0.36
PPARG P37231 1/20 0.36
ESR1 P03372 4/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
PLA2G4B P0C869 1/20 0.34
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LDHA P00338 1/20 0.34
LDHB P07195 1/20 0.34
AKR1B1 P15121 1/20 0.34

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
SCHEMBL5586579 0.91 RXRA (0.33) RXRARARGPPARGAKR1B1
SCHEMBL5586603 0.84 THRB (0.32) THRBRXRARARGPPARGTSHR
SCHEMBL5588409 0.82 LTA4H (0.40) THRATHRBESR1TP53TSHR
SCHEMBL6235777 0.81 THRA (0.38) THRATHRBRXRARARGPPARG
SCHEMBL5587405 0.80 RXRA (0.40) THRATHRBRXRARARGPPARG
SCHEMBL5589323 0.76 AKR1B1 (0.35) LDHALDHBAKR1B1
SCHEMBL5589058 0.74 THRA (0.37) THRATHRBPPARGESR1TP53
SCHEMBL5586808 0.74 THRA (0.41) THRATHRBESR1TP53TSHR
SCHEMBL5587948 0.73 LDHA (0.33) LDHALDHB
SCHEMBL6233833 0.73 KMT2A (0.36) RXRARARGPPARGTP53SMN1; SMN2

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 THRA 3787/4885THRB 3757/4885RXRA 4204/4885

“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.