SCHEMBL6514718

SCHEMBL6514718

C=C(CC(=O)OC(C)C(=O)OC(C)c1ccccc1)C(=O)OC(C)C(=O)OC(C)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.41
KLK7 P49862 3/20 0.38
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
KMT2A Q03164 1/20 0.37
OPRM1 P35372 3/20 0.36
TSHR P16473 1/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
FFAR1 O14842 1/20 0.35
LPAR1 Q92633 2/20 0.34
LPAR3 Q9UBY5 1/20 0.34
MMP8 P22894 1/20 0.34

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
SCHEMBL8812407 0.87 HCAR2 (0.46) HCAR2MAPTKDM4EKMT2AOPRM1
SCHEMBL7041371 0.83 KLK7 (0.41) HCAR2KLK7MAPTKDM4EKMT2A
SCHEMBL6519684 0.82 L3MBTL1 (0.39) KLK7MAPTKMT2ATSHR
SCHEMBL6523978 0.81 ALDH1A1 (0.44) KMT2ATSHR
SCHEMBL7041600 0.80 CYP3A4 (0.42) HCAR2MAPTKMT2A
SCHEMBL10762397 0.80 HCAR2 (0.47) HCAR2MAPTKDM4EKMT2AOPRM1
SCHEMBL6513820 0.78 HCAR2 (0.41) HCAR2KLK7MAPTKDM4EKMT2A
SCHEMBL6515878 0.78 ALDH1A1 (0.46) MAPTKDM4EKMT2ATSHR
SCHEMBL6524022 0.78 TSHR (0.32) TSHR
SCHEMBL7041368 0.76 KLK7 (0.42) HCAR2KLK7MAPTKMT2AOPRM1

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 HCAR2 3143/4885KLK7 4569/4885MAPT 3438/4885

“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.