SCHEMBL5677697

SCHEMBL5677697

CCCCc1cc(OC(=O)O)c(O)cc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.41
TYR P14679 1/20 0.39
PTGES O14684 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
TOP2A P11388 1/20 0.39
TRPV1 Q8NER1 1/20 0.38
HTT P42858 2/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
RAB9A P51151 1/20 0.38
BID P55957 3/20 0.36
MCL1 Q07820 3/20 0.36
BCL2L1 Q07817 2/20 0.36
BAK1 Q16611 2/20 0.36
KAT8 Q9H7Z6 2/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
EP300 Q09472 1/20 0.36
KAT2A Q92830 1/20 0.36

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
SCHEMBL5193722 0.95 PTPN1 (0.45) PTPN1TYRPTGESTOP2ATRPV1
SCHEMBL5678440 0.94 PTPN1 (0.41) PTPN1TYRPTGESNPSR1TOP2A
SCHEMBL5678036 0.91 HMGCR (0.45) PTPN1NPSR1TRPV1HTTHPGD
SCHEMBL5678450 0.90 PTPN1 (0.45) PTPN1TYRPTGESTOP2AHTT
SCHEMBL5678474 0.89 TYR (0.42) PTPN1TYRPTGESTOP2ABID
SCHEMBL5680903 0.86 PTGES (0.45) PTPN1TYRPTGESTOP2AHTT
SCHEMBL5676329 0.86 PTGES (0.45) PTPN1TYRPTGESTOP2AHTT
SCHEMBL5193693 0.86 TYR (0.40) PTPN1TYRPTGESTOP2ABID
SCHEMBL5680663 0.86 TYR (0.40) PTPN1TYRPTGESTOP2ABID
SCHEMBL5676361 0.86 HMGCR (0.44) PTPN1TYRPTGESTOP2ABID

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-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III ZHAO BAIYI 2006-02-16 US disclosed
EP-1620447-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III Exxonmobil Chemical Patents Inc. (US) 2006-02-01 EP disclosed
WO-2003102006-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-12-11 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-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III COMT, CD69, SPR PTPN1 4673/4885TYR 275/4885PTGES 525/4885

“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.