SCHEMBL6523994

SCHEMBL6523994

C=C(CC(=O)Oc1ccc(C)cc1)C(=O)OCC(=O)C(C)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.39
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
NPC1 O15118 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NPSR1 Q6W5P4 2/20 0.36
ALOX5 P09917 1/20 0.36
PTGS1 P23219 1/20 0.36
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
GPR88 Q9GZN0 3/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL6523757 0.93 ALDH1A1 (0.39) ALDH1A1LMNAGAAMEN1KMT2A
SCHEMBL7039893 0.85 ALDH1A1 (0.39) ALDH1A1GAAKMT2AL3MBTL1PTGS1
SCHEMBL6518113 0.85 ALDH1A1 (0.48) ALDH1A1HPGDLMNAGAAMEN1
SCHEMBL6520877 0.84 MMP8 (0.41) ALDH1A1LMNAMEN1KMT2ACYP3A4
SCHEMBL6523115 0.84 GAA (0.47) ALDH1A1LMNAGAAL3MBTL1NPC1
SCHEMBL6520858 0.84 GAA (0.47) ALDH1A1LMNAGAAL3MBTL1NPC1
SCHEMBL6518880 0.81 GAA (0.51) ALDH1A1LMNAGAAMEN1KMT2A
SCHEMBL6519563 0.81 NPC1 (0.53) ALDH1A1LMNAMEN1KMT2AL3MBTL1
SCHEMBL6518196 0.80 KMT2A (0.46) ALDH1A1LMNAGAAMEN1KMT2A
SCHEMBL6514394 0.79 LMNA (0.44) ALDH1A1LMNAGAAMEN1KMT2A

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 ALDH1A1 1254/4885HPGD 4110/4885LMNA 2459/4885

“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.