SCHEMBL17367304

SCHEMBL17367304

CCCCCCCCCCc1cc(C(C)=O)cc(C(=O)OC)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP4A11 Q02928 3/20 0.48
CYP4F2 P78329 2/20 0.48
GPR84 Q9NQS5 2/20 0.45
PTGS2 P35354 4/20 0.45
MDH1 P40925 1/20 0.44
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MGLL Q99685 1/20 0.42
HAO1 Q9UJM8 1/20 0.41
CREBBP Q92793 1/20 0.41

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
SCHEMBL15963129 0.94 CYP4A11 (0.53) CYP4A11CYP4F2GPR84PTGS2MDH1
SCHEMBL25340179 0.91 GPR84 (0.54) CYP4A11CYP4F2GPR84PTGS2MDH1
SCHEMBL27410721 0.89 PTGS2 (0.55) GPR84PTGS2THRATHRBPPARA
SCHEMBL16247137 0.87 CYP4A11 (0.51) CYP4A11CYP4F2GPR84MDH1
SCHEMBL28410139 0.85 GPR84 (0.59) GPR84PTGS2THRATHRBPPARA
SCHEMBL16955938 0.84 CYP4A11 (0.47) CYP4A11CYP4F2GPR84MDH1
SCHEMBL19259022 0.84 CYP4A11 (0.51) CYP4A11CYP4F2GPR84MDH1
SCHEMBL7110194 0.82 CYP4A11 (0.48) CYP4A11CYP4F2GPR84PTGS2MDH1
SCHEMBL17367305 0.81 PLA2G2A (0.59)
SCHEMBL15174508 0.79 CYP4F2 (0.76) CYP4A11CYP4F2MDH1PPARGPPARA

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-20170313652-A1 Poly-Cyanostilbene Macrocycles NATIONAL SCIENCE FOUNDATION 2017-11-02 US disclosed
US-9701621-B2 Poly-cyanostilbene macrocycles INDIANA UNIVERSITY RESEARCH & TECHNOLOGY CORPORATION (US) 2017-07-11 US disclosed
US-20150376122-A1 Poly-Cyanostilbene Macrocycles INDIANA UNIVERSITY RESEARCH & TECHNOLOGY CORPORATION 2015-12-31 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 (2 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-20150376122-A1 Poly-Cyanostilbene Macrocycles PCBP1, HCCS, ACVR2B CYP4A11 2928/4885CYP4F2 730/4885GPR84 3230/4885
US-20170313652-A1 Poly-Cyanostilbene Macrocycles PCBP1, HCCS, ACVR2B CYP4A11 2928/4885CYP4F2 730/4885GPR84 3230/4885

“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.