SCHEMBL6520296

SCHEMBL6520296

O=C(O)CC(C(=O)O)=C(CC(=O)Oc1ccccc1)c1cccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.43
NR4A2 P43354 1/20 0.43
NR4A3 Q92570 1/20 0.43
TDP1 Q9NUW8 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
MMP3 P08254 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
NR1H4 Q96RI1 1/20 0.40
CNR2 P34972 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PTPN1 P18031 1/20 0.39
CDC25B P30305 1/20 0.39
PLK1 P53350 1/20 0.39
SIRT5 Q9NXA8 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
KMT2A Q03164 3/20 0.38

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
SCHEMBL6516699 0.92 NPC1 (0.44) NR4A1NR4A2NR4A3TDP1MAPT
SCHEMBL6518911 0.81 CNR2 (0.50) NR4A1NR4A2NR4A3TDP1KDM4E
SCHEMBL6524366 0.80 NR4A1 (0.46) NR4A1NR4A2NR4A3TDP1KDM4E
SCHEMBL6517378 0.79 ELANE (0.43) TDP1KDM4EMAPTALDH1A1HPGD
SCHEMBL6516613 0.79 NR4A1 (0.45) NR4A1NR4A2NR4A3TDP1KDM4E
SCHEMBL6522232 0.79 MEN1 (0.45) NR4A1NR4A2NR4A3KDM4EMAPT
SCHEMBL6518073 0.78 CNR2 (0.44) NR4A1NR4A2NR4A3KDM4ECNR2
SCHEMBL6520995 0.77 ALDH1A1 (0.47) TDP1KDM4EL3MBTL1ALDH1A1HPGD
SCHEMBL6516628 0.76 MMP12 (0.46) NR4A1NR4A2NR4A3KDM4ENR1H4
SCHEMBL6520797 0.75 KMT2A (0.49) NR4A1NR4A2NR4A3TDP1KDM4E

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 NR4A1 992/4885NR4A2 1815/4885NR4A3 2033/4885

“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.