SCHEMBL6520280

SCHEMBL6520280

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
ACP3 P15309 2/20 0.38
SIRT5 Q9NXA8 1/20 0.38
TRPV1 Q8NER1 1/20 0.35
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPT P10636 3/20 0.34
KIF11 P52732 1/20 0.34
PPARG P37231 2/20 0.33
PPARA Q07869 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
PPARD Q03181 1/20 0.33
HPGD P15428 1/20 0.33
CYP1A2 P05177 2/20 0.33
CYP19A1 P11511 1/20 0.33
CDC25B P30305 1/20 0.32
NR4A1 P22736 1/20 0.32

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
SCHEMBL6516686 0.92 L3MBTL1 (0.40) TDP1L3MBTL1ACP3SIRT5KDM4E
SCHEMBL6518899 0.81 TDP1 (0.39) TDP1L3MBTL1ACP3KDM4EALDH1A1
SCHEMBL6524358 0.81 ACP3 (0.46) TDP1L3MBTL1ACP3KDM4EALDH1A1
SCHEMBL6517368 0.80 CYP19A1 (0.38) TDP1L3MBTL1ALDH1A1MAPTCYP2C19
SCHEMBL6516604 0.80 ACP3 (0.39) TDP1L3MBTL1ACP3KDM4EALDH1A1
SCHEMBL6522226 0.80 MEN1 (0.39) L3MBTL1ACP3KDM4EALDH1A1HSD17B10
SCHEMBL6516619 0.77 CYP1A1 (0.40) TDP1L3MBTL1ACP3TRPV1ALDH1A1
SCHEMBL6520788 0.76 KMT2A (0.40) L3MBTL1ACP3KDM4EALDH1A1MAPT
SCHEMBL6515918 0.75 ACP3 (0.36) ACP3KDM4EALDH1A1HSD17B10PPARG
SCHEMBL6520850 0.75 ALDH1A1 (0.38) TDP1L3MBTL1ALDH1A1MAPTKIF11

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 1789/4885L3MBTL1 1615/4885ACP3 4282/4885

“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.