SCHEMBL6523830

SCHEMBL6523830

CC(C(=O)OCCOCc1ccccc1)C(=C(CC(=O)O)C(=O)O)C(C)C(=O)OCCOCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.41
HTT P42858 1/20 0.41
KDM4E B2RXH2 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
CASP1 P29466 1/20 0.39
LMNA P02545 1/20 0.39
ALDH1A1 P00352 2/20 0.39
CTSB P07858 2/20 0.38
FOLH1 Q04609 1/20 0.38
ELANE P08246 1/20 0.37
NAAA Q02083 1/20 0.37
MME P08473 1/20 0.37

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
SCHEMBL6523871 0.90 TDP1 (0.38) SMN1; SMN2KDM4ETDP1
SCHEMBL6523976 0.88 ALDH1A1 (0.47) HTTKDM4ETDP1ALDH1A1CTSB
SCHEMBL6515874 0.82 RAB9A (0.47) SMN1; SMN2HTTKDM4ETDP1LMNA
SCHEMBL6515855 0.79 ALDH1A1 (0.42) SMN1; SMN2KDM4ETDP1ALDH1A1
SCHEMBL6520306 0.78 FNTA (0.31) HTTKDM4EALDH1A1
SCHEMBL6513720 0.77 TDP1 (0.44) SMN1; SMN2HTTTDP1CASP1LMNA
SCHEMBL13538119 0.77 ALDH1A1 (0.50) SMN1; SMN2HTTTDP1LMNAALDH1A1
SCHEMBL13538122 0.76 ALDH1A1 (0.49) SMN1; SMN2HTTTDP1LMNAALDH1A1
SCHEMBL6514759 0.76 MAPT (0.37) HTTKDM4EALDH1A1
SCHEMBL6519680 0.75 L3MBTL1 (0.42) TDP1LMNAALDH1A1ELANE

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 SMN1; SMN2 1768/4885HTT 3273/4885KDM4E 329/4885

“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.