SCHEMBL5678257

SCHEMBL5678257

CCCc1ccc(N(CC)CC)c(O)c1OC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.38
TP53 P04637 1/20 0.33
HTT P42858 1/20 0.33
HCAR3 P49019 1/20 0.33
PTPN1 P18031 3/20 0.32
PTPN11 Q06124 2/20 0.32
PTPN2 P17706 1/20 0.32
RARA P10276 3/20 0.31
RARB P10826 3/20 0.31
RARG P13631 3/20 0.31
PPARG P37231 2/20 0.31
PPARA Q07869 2/20 0.31
ESRRG P62508 2/20 0.30
ELANE P08246 2/20 0.30
CTSG P08311 1/20 0.30

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
SCHEMBL5678046 0.92 TYR (0.36) TP53HTTHCAR3RARARARB
SCHEMBL5590181 0.83 PRKCI (0.49) PRKCIPTPN1PTPN11PTPN2PPARG
SCHEMBL5680221 0.82 PRKCI (0.44) PRKCIPTPN1PTPN11PTPN2PPARG
SCHEMBL5680235 0.79 PRKCI (0.41) PRKCIPTPN1PTPN11PTPN2PPARG
SCHEMBL5196217 0.79 PRKCI (0.47) PRKCIPTPN1PTPN11PTPN2PPARG
SCHEMBL5680839 0.78 PRKCI (0.44) PRKCIPPARGPPARAELANECTSG
SCHEMBL5676020 0.78 PRKCI (0.44) PRKCIPPARGPPARAELANECTSG
SCHEMBL5677938 0.77 TYR (0.46) PRKCITP53HTTPPARGPPARA
SCHEMBL5680228 0.77 TYR (0.46) PRKCITP53HTTPPARGPPARA
SCHEMBL5678255 0.76 PRKCI (0.43) PRKCITP53HTTHCAR3ELANE

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 PRKCI 4096/4885TP53 1482/4885HTT 2378/4885

“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.