SCHEMBL6517490

SCHEMBL6517490

O=C(/C=C/C(=O)OCc1ccccc1)OCC(=O)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.68
LMNA P02545 1/20 0.59
AKR1B10 O60218 2/20 0.55
AKR1B1 P15121 2/20 0.55
CA12 O43570 1/20 0.55
CA4 P22748 1/20 0.55
CA6 P23280 1/20 0.55
CA5A P35218 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
CA5B Q9Y2D0 1/20 0.55
KMT2A Q03164 3/20 0.54
SLC6A2 P23975 1/20 0.54
SLC6A3 Q01959 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ALDH1A1 P00352 4/20 0.52
MEN1 O00255 1/20 0.51
TTR P02766 1/20 0.50
MAPT P10636 2/20 0.49

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
SCHEMBL6514319 0.90 KMT2A (0.62) HCAR2LMNAAKR1B10AKR1B1CA12
SCHEMBL6525842 0.86 HCAR2 (0.55) HCAR2LMNAAKR1B10AKR1B1CA12
SCHEMBL357565 0.86 HCAR2 (0.89) HCAR2LMNAAKR1B10AKR1B1CA12
SCHEMBL337503 0.86 HCAR2 (0.89) HCAR2LMNAAKR1B10AKR1B1CA12
SCHEMBL337504 0.86 HCAR2 (0.89) HCAR2LMNAAKR1B10AKR1B1CA12
SCHEMBL27659194 0.84 HCAR2 (0.85) HCAR2LMNAAKR1B10AKR1B1CA12
SCHEMBL29098739 0.83 HCAR2 (0.72) HCAR2LMNAAKR1B10AKR1B1CA12
SCHEMBL6517313 0.82 KMT2A (0.56) HCAR2LMNAKMT2ATDP1ALDH1A1
SCHEMBL6513381 0.82 HCAR2 (0.70) HCAR2LMNAAKR1B10AKR1B1CA12
SCHEMBL6516704 0.82 KMT2A (0.59) LMNAKMT2ATDP1ALDH1A1MEN1

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 HCAR2 3143/4885LMNA 2459/4885AKR1B10 2430/4885

“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.