SCHEMBL6523622

SCHEMBL6523622

COCCC(C(=O)O)=C(CC(=O)Cc1ccccc1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
LMNA P02545 3/20 0.43
ALDH1A1 P00352 3/20 0.43
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPK1 P28482 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 2/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA3 P07451 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CACNA1C Q13936 1/20 0.40
SCN9A Q15858 1/20 0.40

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
SCHEMBL6523613 1.00 KDM4E (0.43) KDM4ELMNAALDH1A1TDP1L3MBTL1
SCHEMBL6523968 0.83 LMNA (0.40) KDM4ELMNAALDH1A1TDP1L3MBTL1
SCHEMBL6525919 0.78 KMT2A (0.50) KDM4ELMNAALDH1A1TDP1L3MBTL1
SCHEMBL6525927 0.78 KMT2A (0.50) KDM4ELMNAALDH1A1TDP1L3MBTL1
SCHEMBL8964582 0.76 KDM4E (0.54) KDM4ELMNAALDH1A1TDP1L3MBTL1
SCHEMBL6516505 0.76 CES2 (0.45) KDM4EALDH1A1TDP1L3MBTL1MEN1
SCHEMBL6516498 0.76 CES2 (0.45) KDM4EALDH1A1TDP1L3MBTL1MEN1
SCHEMBL6516721 0.75 ALDH1A1 (0.35) ALDH1A1TDP1
SCHEMBL6516713 0.75 ALDH1A1 (0.35) ALDH1A1TDP1
SCHEMBL11329510 0.74 ALDH1A1 (0.46) KDM4ELMNAALDH1A1MAPK1

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 KDM4E 329/4885LMNA 2459/4885ALDH1A1 1254/4885

“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.