SCHEMBL6514696

SCHEMBL6514696

CC(=O)C/C(C(=O)O)=C(\C(=O)O)C1CCCC1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
EPHX1 P07099 1/20 0.32
NAAA Q02083 1/20 0.32
TLR4 O00206 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
HPGD P15428 1/20 0.30

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
SCHEMBL6514709 1.00 SMN1; SMN2 (0.35) SMN1; SMN2HSD17B10HDAC8HDAC6CES2
SCHEMBL6523448 0.82 CES2 (0.34) SMN1; SMN2HSD17B10HDAC8HDAC6CES2
SCHEMBL6523453 0.82 CES2 (0.34) SMN1; SMN2HSD17B10HDAC8HDAC6CES2
SCHEMBL6516582 0.81 EPHX2 (0.37) SMN1; SMN2HSD17B10HDAC8HDAC6CES2
SCHEMBL6516574 0.81 EPHX2 (0.37) SMN1; SMN2HSD17B10HDAC8HDAC6CES2
SCHEMBL6524001 0.81 CES2 (0.38) SMN1; SMN2HSD17B10HDAC8HDAC6CES2
SCHEMBL6513745 0.81 CES2 (0.38) SMN1; SMN2HSD17B10HDAC8HDAC6CES2
SCHEMBL6523993 0.81 CES2 (0.38) SMN1; SMN2HSD17B10HDAC8HDAC6CES2
SCHEMBL6513755 0.81 CES2 (0.38) SMN1; SMN2HSD17B10HDAC8HDAC6CES2
SCHEMBL6520968 0.80 NAAA (0.36) SMN1; SMN2HSD17B10HDAC8HDAC6CES2

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 SMN1; SMN2 1768/4885HSD17B10 2626/4885HDAC8 3116/4885

“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.