SCHEMBL6516032

SCHEMBL6516032

C=C(CC(=O)OC)C(=O)OCC(=O)OCCOCCCCCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
NAAA Q02083 1/20 0.41
DGKA P23743 1/20 0.41
CES2 O00748 2/20 0.41
FAAH O00519 2/20 0.39
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.39
RAD52 P43351 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
EPHX1 P07099 1/20 0.36
EPHX2 P34913 1/20 0.36
POLB P06746 1/20 0.36
POLA1 P09884 1/20 0.36
HTR2C P28335 1/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35

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
SCHEMBL6523169 0.93 FAAH (0.43) TSHRNAAADGKACES2FAAH
SCHEMBL6515945 0.92 FAAH (0.40) TSHRNAAADGKACES2FAAH
SCHEMBL6520524 0.92 FAAH (0.46) TSHRNAAADGKACES2FAAH
SCHEMBL23306689 0.92 TSHR (0.50) TSHRNAAADGKACES2FAAH
SCHEMBL6515076 0.87 DGKA (0.38) TSHRNAAADGKACES2FAAH
SCHEMBL6519432 0.87 FAAH (0.39) TSHRNAAADGKACES2FAAH
SCHEMBL23306340 0.87 TSHR (0.56) TSHRNAAACES2FAAHMEN1
SCHEMBL6515504 0.86 NAAA (0.53) TSHRNAAADGKAFAAHRAD52
SCHEMBL6518799 0.86 TSHR (0.41) TSHRNAAADGKAFAAHRAD52
SCHEMBL6514782 0.84 TSHR (0.51) TSHRNAAADGKAFAAHRAD52

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-6958366-B2 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-25 US disclosed
US-20030118544-A1 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-06-26 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-20030118544-A1 Antifouling coating composition and novel resin COL1A1, GLRA1, COL2A1 TSHR 3581/4885NAAA 2110/4885DGKA 3006/4885

“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.