SCHEMBL13096347

SCHEMBL13096347

CCCCCCCCCCCCCCCCc1cc(C)sc1-c1sc(-c2sc(C)c3c2C(=O)N(CCCCCCCCCCCCCCCC)C3=O)cc1CCCCCCCCCCCCCCCC

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 3/20 0.33
▸ PTGS2 P35354 3/20 0.33
▸ MGLL Q99685 2/20 0.33
▸ FAAH O00519 1/20 0.33
▸ CES1 P23141 2/20 0.30
▸ CDC25A P30304 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ HSP90AA1 P07900 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ G6PD P11413 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ HIF1A Q16665 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ NR1H2 P55055 1/20 0.30
▸ NR1H3 Q13133 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
SCHEMBL13096352 1.00 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHCES1
SCHEMBL16307242 0.98 PTGS1 (0.32) PTGS1PTGS2MGLLFAAH
SCHEMBL16307269 0.86 — —
SCHEMBL16307265 0.84 PTGS1 (0.32) PTGS1PTGS2MGLLFAAHCES1
SCHEMBL17528652 0.84 PTGS1 (0.32) PTGS1PTGS2MGLLFAAHCES1
SCHEMBL16307286 0.84 HSF1 (0.33) PTGS1PTGS2MGLLFAAHCES1
SCHEMBL16307263 0.84 PTGS1 (0.32) PTGS1PTGS2MGLLFAAHCES1
SCHEMBL17188374 0.83 PTGS1 (0.30) PTGS1PTGS2MGLLFAAH
SCHEMBL17188378 0.83 — —
SCHEMBL19758028 0.82 — —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8927971-B2 Semiconducting compounds and devices incorporating same UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2015-01-06 — — US disclosed
US-20100252112-A1 Semiconducting Compounds and Devices Incorporating Same POLYERA CORPORATION 2010-10-07 — — 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-20100252112-A1 Semiconducting Compounds and Devices Incorporating Same HTT, SUV39H1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 PTGS1 3764/4885PTGS2 3456/4885MGLL 1961/4885

“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.

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