SCHEMBL6519192

SCHEMBL6519192

C=C(CC(=O)OC1CCCCC1)C(=O)OCC(=O)OC1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.41
NAAA Q02083 2/20 0.41
EPHX1 P07099 3/20 0.40
HTT P42858 1/20 0.40
CYP19A1 P11511 3/20 0.38
CXCR1 P25024 1/20 0.37
CXCR2 P25025 1/20 0.37
MIF P14174 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
HSD17B10 Q99714 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31

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
SCHEMBL6523837 1.00 CYP2C19 (0.41) CYP2C19NAAAEPHX1HTTCYP19A1
SCHEMBL6513734 0.98 NAAA (0.39) CYP2C19NAAAEPHX1HTTCYP19A1
SCHEMBL6521098 0.95 CYP2C19 (0.41) CYP2C19NAAAEPHX1HTTCYP19A1
SCHEMBL6517224 0.94 NAAA (0.38) CYP2C19NAAAEPHX1HTTCYP19A1
SCHEMBL22615480 0.91 CYP2C19 (0.40) CYP2C19NAAAEPHX1HTTCYP19A1
SCHEMBL22615802 0.91 CYP2C19 (0.40) CYP2C19NAAAEPHX1HTTCYP19A1
SCHEMBL22615603 0.91 CYP2C19 (0.40) CYP2C19NAAAEPHX1HTTCYP19A1
SCHEMBL6520319 0.91 NAAA (0.40) CYP2C19NAAAEPHX1HTTCYP19A1
SCHEMBL6519502 0.91 NAAA (0.40) CYP2C19NAAAEPHX1HTTCYP19A1
SCHEMBL6522375 0.90 NAAA (0.42) CYP2C19NAAAEPHX1HTTCYP19A1

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 CYP2C19 2771/4885NAAA 2110/4885EPHX1 558/4885

“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.