SCHEMBL6513813

SCHEMBL6513813

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

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.42
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
LPAR1 Q92633 2/20 0.37
TSHR P16473 1/20 0.36
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
FFAR1 O14842 1/20 0.35
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
OPRM1 P35372 3/20 0.34
HTT P42858 1/20 0.33
HPGD P15428 1/20 0.33
KLK7 P49862 1/20 0.33
POLB P06746 1/20 0.33
GPR139 Q6DWJ6 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
SCHEMBL6522175 0.93 HCAR2 (0.40) HCAR2MAPTKDM4ELPAR1TSHR
SCHEMBL6521135 0.87 ALDH1A1 (0.37) HCAR2MAPTKDM4ELPAR1ALDH1A1
SCHEMBL6518104 0.79 GPR139 (0.38) HCAR2MAPTKDM4ELPAR1ALDH1A1
SCHEMBL16673279 0.77 HCAR2 (0.50) HCAR2MAPTKDM4ELPAR1TSHR
SCHEMBL6522450 0.76 CYP19A1 (0.41) MAPTALDH1A1HSD17B10HPGD
SCHEMBL8650508 0.76 HCAR2 (0.49) HCAR2MAPTKDM4ELPAR1TSHR
SCHEMBL6947823 0.74 MAPT (0.51) HCAR2MAPTKDM4ELPAR1TSHR
SCHEMBL6966052 0.74 HCAR2 (0.53) HCAR2MAPTKDM4ELPAR1TSHR
SCHEMBL11461421 0.73 HCAR2 (0.56) HCAR2MAPTKDM4ELPAR1TSHR
SCHEMBL3883004 0.73 HCAR2 (0.56) HCAR2MAPTKDM4ELPAR1TSHR

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 3143/4885MAPT 3438/4885KDM4E 329/4885

“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.