SCHEMBL6517301

SCHEMBL6517301

O=C(CC(C(=O)O)=C(C(=O)O)C1CCCC1)Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.48
ALDH1A1 P00352 7/20 0.44
HPGD P15428 2/20 0.44
USP2 O75604 1/20 0.44
CYP2C19 P33261 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
ALOX12 P18054 2/20 0.41
KDM4E B2RXH2 3/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL6517293 1.00 EPHX2 (0.48) EPHX2ALDH1A1HPGDUSP2CYP2C19
SCHEMBL10193611 0.88 EPHX2 (0.49) EPHX2ALDH1A1HPGDUSP2CYP2C19
SCHEMBL9709177 0.86 EPHX2 (0.51) EPHX2ALDH1A1HPGDUSP2CYP2C19
SCHEMBL305796 0.86 EPHX2 (0.47) EPHX2ALDH1A1HPGDUSP2CYP2C19
SCHEMBL305798 0.86 EPHX2 (0.47) EPHX2ALDH1A1HPGDUSP2CYP2C19
SCHEMBL9709173 0.86 EPHX2 (0.51) EPHX2ALDH1A1HPGDUSP2CYP2C19
SCHEMBL6521052 0.85 ALDH1A1 (0.54) EPHX2ALDH1A1HPGDUSP2CYP2C19
SCHEMBL6521038 0.85 ALDH1A1 (0.54) EPHX2ALDH1A1HPGDUSP2CYP2C19
SCHEMBL6515143 0.80 EPHX2 (0.46) EPHX2ALDH1A1HPGDUSP2CYP2C19
SCHEMBL6515492 0.79 ERCC5 (0.51) ALDH1A1HPGDCYP2C19MEN1KMT2A

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 EPHX2 661/4885ALDH1A1 1254/4885HPGD 4110/4885

“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.