SCHEMBL7041364

SCHEMBL7041364

COCCOC(=O)C(OC(=O)/C=C/C(=O)OC(C(=O)OCCOC)C1CCCCC1)C1CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
NPSR1 Q6W5P4 4/20 0.34
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
MMP2 P08253 2/20 0.33
CA9 Q16790 2/20 0.33
CYP3A4 P08684 3/20 0.32
LMNA P02545 3/20 0.32
ALDH1A1 P00352 2/20 0.32
CHRM2 P08172 1/20 0.32
HTR1A P08908 1/20 0.32
ADRA2A P08913 1/20 0.32
CHRM1 P11229 1/20 0.32
DRD1 P21728 1/20 0.32
SLC6A2 P23975 1/20 0.32
ADRA1A P35348 1/20 0.32
OPRM1 P35372 1/20 0.32
DRD3 P35462 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
SCHEMBL7041362 0.95 HCAR2 (0.41) EPHX2SMN1; SMN2NPSR1CYP3A4LMNA
SCHEMBL6522602 0.74 HCAR2 (0.39) SMN1; SMN2CA12CA1CA2CA9
SCHEMBL4641781 0.73 HCAR2 (0.38) NPSR1ALDH1A1SLC6A3TP53HCAR2
SCHEMBL4647644 0.73 HCAR2 (0.38) NPSR1ALDH1A1SLC6A3TP53HCAR2
SCHEMBL18288672 0.72 HCAR2 (0.35) SMN1; SMN2NPSR1CYP3A4LMNATP53
SCHEMBL18288673 0.72 HCAR2 (0.35) SMN1; SMN2NPSR1CYP3A4LMNATP53
SCHEMBL18288699 0.72 OPRM1 (0.33) SMN1; SMN2NPSR1CYP3A4LMNAALDH1A1
SCHEMBL18288689 0.72 OPRM1 (0.33) SMN1; SMN2NPSR1CYP3A4LMNAALDH1A1
SCHEMBL4645230 0.71 HCAR2 (0.40) NPSR1CA12CA1CA2CA9
SCHEMBL4646033 0.71 HCAR2 (0.40) NPSR1CA12CA1CA2CA9

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 EPHX2 661/4885SMN1; SMN2 1768/4885NPSR1 4153/4885

“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.