SCHEMBL69861

SCHEMBL69861

CCC(C)c1c(C)c(O)cc(O)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
ALOX15 P16050 2/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
RORC P51449 1/20 0.40
HDAC4 P56524 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
ACHE P22303 1/20 0.39
RXRA P19793 1/20 0.34
CYP3A4 P08684 1/20 0.33
ALOX12 P18054 1/20 0.33
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
FFAR1 O14842 2/20 0.31
PTGES O14684 1/20 0.31

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
SCHEMBL69217 0.77 ALDH1A1 (0.50) TSHRALOX15USP2ALDH1A1GAA
SCHEMBL4912196 0.77 TSHR (0.39) TSHRALOX15USP2ALDH1A1GAA
SCHEMBL29174139 0.77 TSHR (0.44) TSHRALOX15USP2ALDH1A1GAA
SCHEMBL20621450 0.74 RXRA (0.46) TSHRALOX15USP2ALDH1A1GAA
SCHEMBL16018022 0.74 CYP3A4 (0.42) TSHRALOX15USP2ALDH1A1GAA
SCHEMBL16010402 0.74 RXRA (0.42) TSHRALOX15USP2ALDH1A1GAA
SCHEMBL5273948 0.74 TSHR (0.41) TSHRALOX15USP2ALDH1A1GAA
SCHEMBL28724211 0.73 TSHR (0.54) TSHRALOX15USP2ALDH1A1GAA
SCHEMBL31545516 0.71 RORC (0.47) TSHRALOX15USP2ALDH1A1GAA
SCHEMBL11701337 0.71 TSHR (0.52) TSHRALOX15USP2ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2479203-A1 AROMATIC POLYESTER Muroran Institute of Technology (JP) 2012-07-25 EP disclosed
US-20120172570-A1 AROMATIC POLYESTER NITTA CORPORATION 2012-07-05 US disclosed
US-8129493-B2 Aromatic polyester MURORAN INSTITUTE OF TECHNOLOGY (JP) 2012-03-06 US disclosed
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME MURORAN INSTITUTE OF TECHNOLOGY (JP) 2011-09-15 US disclosed
US-20110092662-A1 AROMATIC POLYESTER NITTA CORPORATION (JP) 2011-04-21 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-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME F12, PHAX, WDR82 TSHR 3263/4885ALOX15 1966/4885USP2 2928/4885

“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.