SCHEMBL6519491

SCHEMBL6519491

C=C(C(=O)O)C(CC(=O)OCCOCCCCCC)(C(=O)O)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.36
NAAA Q02083 4/20 0.36
DGKA P23743 1/20 0.35
TSHR P16473 2/20 0.33
MEN1 O00255 1/20 0.33
THRB P10828 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
CES2 O00748 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
RAD52 P43351 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL6520853 0.81 KMT2A (0.38) TSHRMEN1THRBKMT2ACHRM2
SCHEMBL6523158 0.79 NAAA (0.41) EPHX2NAAADGKATSHRMEN1
SCHEMBL6525936 0.78 NAAA (0.40) NAAATSHRMEN1KMT2AMAPT
SCHEMBL6516024 0.78 NAAA (0.41) EPHX2NAAADGKATSHRMEN1
SCHEMBL6519493 0.75 EPHX2 (0.36) EPHX2
SCHEMBL6515080 0.74 TSHR (0.37) NAAADGKATSHRTHRB
SCHEMBL6515939 0.74 NAAA (0.36) EPHX2NAAADGKATSHRMEN1
SCHEMBL6523828 0.72 CYP2C19 (0.39) NAAAHTTMAPT
SCHEMBL6519186 0.72 CYP2C19 (0.39) NAAAHTTMAPT
SCHEMBL6518888 0.72

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 EPHX2 661/4885NAAA 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.