SCHEMBL6523102

SCHEMBL6523102

COCCOC(=O)CC(C(=O)O)=C(CC(=O)OCCOC)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.38
GAA P10253 3/20 0.36
MGAM O43451 2/20 0.36
SI P14410 2/20 0.36
MGAM2 Q2M2H8 2/20 0.36
ALDH1A1 P00352 2/20 0.34
DGKA P23743 1/20 0.33
FAAH O00519 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
ADRA2A P08913 1/20 0.31
ADRA1A P35348 1/20 0.31
KDM4E B2RXH2 3/20 0.31
MAPT P10636 2/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
THRB P10828 1/20 0.31
HPGD P15428 1/20 0.31
RECQL P46063 1/20 0.31
XIAP P98170 1/20 0.31
KMT2A Q03164 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
SCHEMBL6523095 1.00 TSHR (0.38) TSHRGAAMGAMSIMGAM2
SCHEMBL6521075 0.92 ALDH1A1 (0.34) TSHRGAAMGAMSIMGAM2
SCHEMBL6521086 0.92 ALDH1A1 (0.34) TSHRGAAMGAMSIMGAM2
SCHEMBL6515138 0.88 FNTA (0.35) TSHRGAAMGAMSIMGAM2
SCHEMBL6515128 0.88 FNTA (0.35) TSHRGAAMGAMSIMGAM2
SCHEMBL6513347 0.88 ALDH1A1 (0.41) TSHRGAAMGAMSIMGAM2
SCHEMBL6513333 0.88 ALDH1A1 (0.41) TSHRGAAMGAMSIMGAM2
SCHEMBL813498 0.84 MGAM (0.50) TSHRGAAMGAMSIMGAM2
SCHEMBL6520772 0.83 TSHR (0.33) TSHRGAAMGAMSIMGAM2
SCHEMBL6518603 0.82 ALDH1A1 (0.34) TSHRALDH1A1DGKAMEN1HPGD

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 3581/4885GAA 3231/4885MGAM 2878/4885

“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.