SCHEMBL6520503

SCHEMBL6520503

C=C(C(=O)O)C(CCOC)(CC(=O)OCC)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
PTPN1 P18031 1/20 0.31
PTPRB P23467 1/20 0.31
ACP1 P24666 1/20 0.31
ALDH1A1 P00352 3/20 0.31
TRPA1 O75762 1/20 0.31
CYP3A4 P08684 2/20 0.31
ALOX15 P16050 2/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
CHRM1 P11229 1/20 0.30
ADORA1 P30542 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL6518591 0.90
SCHEMBL6523700 0.86 TET2 (0.30) HSD17B10
SCHEMBL6514741 0.86 GAA (0.40) MGAMGAASIMGAM2PTPN1
SCHEMBL6514660 0.83 GAA (0.38) MGAMGAASIMGAM2PTPN1
SCHEMBL6521114 0.82
SCHEMBL6524379 0.81 TET2 (0.31)
SCHEMBL6520770 0.81 TSHR (0.32) TSHR
SCHEMBL6514986 0.81 THRB (0.41) ALDH1A1TSHR
SCHEMBL6515939 0.81 NAAA (0.36) CYP3A4TSHR
SCHEMBL6523574 0.80 ALDH1A1 (0.42) PTPN1ALDH1A1CYP3A4TDP1SMN1; SMN2

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 MGAM 2878/4885GAA 3231/4885SI 4878/4885

“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.