SCHEMBL6523728

SCHEMBL6523728

O=C(O)C(=Cc1ccccc1)C(CC(=O)C1CCCC1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.38
ALDH1A1 P00352 3/20 0.37
HSD17B10 Q99714 1/20 0.37
KDM4E B2RXH2 2/20 0.36
LMNA P02545 1/20 0.36
AKR1C3 P42330 1/20 0.36
HSD11B1 P28845 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
AKR1C1 Q04828 1/20 0.35
GRIK1 P39086 1/20 0.35
GRIK2 Q13002 1/20 0.35
TRPM8 Q7Z2W7 1/20 0.35
HTT P42858 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.33

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
SCHEMBL6520981 0.88 TRPM8 (0.36) HPGDALDH1A1AKR1C3CYP3A4CYP2C9
SCHEMBL6515922 0.80 KDM4E (0.42) HPGDALDH1A1HSD17B10KDM4EGRIK1
SCHEMBL6522166 0.80 CYP19A1 (0.38) HPGDALDH1A1HSD17B10KDM4ELMNA
SCHEMBL6522196 0.77 GRIK1 (0.35) GRIK1GRIK2
SCHEMBL6520258 0.76 AKR1C3 (0.50) ALDH1A1LMNAAKR1C3CYP3A4CYP2C9
SCHEMBL6522218 0.75 TSHR (0.51) HPGDALDH1A1HSD17B10KDM4ELMNA
SCHEMBL6519776 0.75 GRIK1 (0.46) GRIK1GRIK2
SCHEMBL6519405 0.74 GRIK1 (0.48) GRIK1GRIK2
SCHEMBL6515957 0.74 GRIK1 (0.48) GRIK1GRIK2
SCHEMBL6515807 0.72 AKR1C3 (0.42) ALDH1A1AKR1C3CYP3A4CYP2C9AKR1C1

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 HPGD 4110/4885ALDH1A1 1254/4885HSD17B10 2626/4885

“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.