SCHEMBL6523232

SCHEMBL6523232

CCC(C(=O)O)=C(CC(=O)OC1CCCCC1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.49
EPHX1 P07099 2/20 0.49
HTT P42858 4/20 0.47
CYP2C19 P33261 1/20 0.42
CYP19A1 P11511 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 3/20 0.35
POLB P06746 1/20 0.34
CHRM2 P08172 3/20 0.34
CHRM4 P08173 3/20 0.34
CHRM5 P08912 3/20 0.34
CHRM1 P11229 3/20 0.34
CHRM3 P20309 3/20 0.34
MAPT P10636 1/20 0.34
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.33
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 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
SCHEMBL6523230 1.00 NAAA (0.49) NAAAEPHX1HTTCYP2C19CYP19A1
SCHEMBL6513394 0.91 HTT (0.50) NAAAEPHX1HTTCYP2C19CYP19A1
SCHEMBL6513403 0.91 HTT (0.50) NAAAEPHX1HTTCYP2C19CYP19A1
SCHEMBL6519695 0.89 HTT (0.47) NAAAEPHX1HTTCYP2C19CYP19A1
SCHEMBL6519704 0.89 HTT (0.47) NAAAEPHX1HTTCYP2C19CYP19A1
SCHEMBL17073974 0.83 EPHX1 (0.47) NAAAEPHX1HTTCYP2C19CYP19A1
SCHEMBL17073965 0.83 EPHX1 (0.47) NAAAEPHX1HTTCYP2C19CYP19A1
SCHEMBL6522376 0.81 NAAA (0.44) NAAAEPHX1HTTCYP2C19CYP19A1
SCHEMBL6516597 0.81 HTT (0.45) NAAAEPHX1HTTCYP2C19CYP19A1
SCHEMBL6516587 0.81 HTT (0.45) NAAAEPHX1HTTCYP2C19CYP19A1

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 NAAA 2110/4885EPHX1 558/4885HTT 3273/4885

“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.