SCHEMBL6524375

SCHEMBL6524375

COC(=O)CC(=C(CC(=O)O)C(=O)O)c1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.44
KMT2A Q03164 2/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 6/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ESRRB O95718 1/20 0.38
LMNA P02545 2/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
CES2 O00748 2/20 0.37
CES1 P23141 2/20 0.37
SRD5A2 P31213 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL6515811 0.87 ESRRB (0.47) TDP1KMT2ARAB9AMEN1NPC1
SCHEMBL6518882 0.87 KMT2A (0.46) TDP1KMT2ARAB9AMEN1NPC1
SCHEMBL6524262 0.86 TDP1 (0.44) TDP1KMT2ARAB9AMEN1NPC1
SCHEMBL6520861 0.84 KMT2A (0.43) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL6518823 0.84 NPC1 (0.43) TDP1KMT2ARAB9AMEN1NPC1
SCHEMBL6515905 0.84 NPC1 (0.56) TDP1KMT2ARAB9AMEN1NPC1
SCHEMBL6514397 0.82 LMNA (0.47) TDP1KMT2ARAB9AMEN1NPC1
SCHEMBL6523117 0.81 ELANE (0.44) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL6519448 0.81 SMN1; SMN2 (0.39) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL6518116 0.80 MEN1 (0.39) KMT2ARAB9AMEN1NPC1ALDH1A1

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 TDP1 1789/4885KMT2A 1067/4885RAB9A 2333/4885

“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.