SCHEMBL7041371

SCHEMBL7041371

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

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KLK7 P49862 7/20 0.41
HCAR2 Q8TDS4 1/20 0.39
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
KDM4E B2RXH2 2/20 0.35
MAPT P10636 1/20 0.35
MMP8 P22894 1/20 0.35
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CYP2D6 P10635 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
OPRM1 P35372 2/20 0.34
LMNA P02545 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
SCHEMBL7041368 0.91 KLK7 (0.42) KLK7HCAR2KMT2AMEN1MAPT
SCHEMBL8812407 0.84 HCAR2 (0.46) HCAR2KMT2AMEN1KDM4EMAPT
SCHEMBL6514718 0.83 HCAR2 (0.41) KLK7HCAR2KMT2AKDM4EMAPT
SCHEMBL7041600 0.77 CYP3A4 (0.42) HCAR2KMT2AMEN1MAPTCYP2D6
SCHEMBL10762397 0.77 HCAR2 (0.47) HCAR2KMT2AMEN1KDM4EMAPT
SCHEMBL6513820 0.75 HCAR2 (0.41) KLK7HCAR2KMT2AKDM4EMAPT
SCHEMBL16672728 0.75 HCAR2 (0.49) HCAR2KMT2AMEN1KDM4EMAPT
SCHEMBL6522180 0.75 NLRP3 (0.41) HCAR2KMT2AMEN1MAPTMMP8
SCHEMBL3883004 0.73 HCAR2 (0.56) HCAR2KMT2AMEN1KDM4EMAPT
SCHEMBL10204727 0.72 HCAR2 (0.49) KLK7HCAR2KMT2AKDM4EMAPT

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 KLK7 4569/4885HCAR2 3143/4885KMT2A 1067/4885

“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.