SCHEMBL11380285

SCHEMBL11380285

O=Cc1cc(B(O)O)cc(B(O)O)c1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.58
PTGS2 P35354 1/20 0.36
RAB9A P51151 1/20 0.36
ALDH5A1 P51649 1/20 0.35
ABAT P80404 1/20 0.35
TTR P02766 1/20 0.34
ENPP2 Q13822 2/20 0.34
XDH P47989 1/20 0.32
SRC P12931 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32

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
SCHEMBL1619086 0.95 KDM4E (0.58) KDM4EPTGS2RAB9AALDH5A1ABAT
SCHEMBL1072576 0.84 KDM4E (0.48) KDM4EPTGS2RAB9AENPP2SRC
SCHEMBL1771343 0.84 KDM4E (0.48) KDM4EPTGS2RAB9AENPP2
SCHEMBL9301841 0.84 KDM4E (0.48) KDM4EPTGS2RAB9AENPP2
SCHEMBL4655558 0.84 KDM4E (0.48) KDM4EPTGS2RAB9AENPP2
Hydrochloric Acid SCHEMBL4652877 0.83 KDM4E (0.47) KDM4EENPP2
SCHEMBL14186117 0.81 ENPP2 (0.46) KDM4EENPP2
SCHEMBL29700460 0.80 MGLL (0.47) KDM4E
SCHEMBL21854599 0.80 MGLL (0.47) KDM4E
SCHEMBL4955182 0.78 KDM4E (0.42) KDM4EALDH5A1ABATTTRXDH

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210024604-A1 NOVEL INSULIN DERIVATIVES NOVO NORDISK AS (DK) 2021-01-28 US disclosed
WO-2016179568-A1 GLUCOSE RESPONSIVE INSULINS PROTOMER TECHNOLOGIES, INC. (US) 2016-11-10 WO disclosed
US-20120184487-A1 INSULIN DERIVATIVES NOVO NORDISK A/S (DK) 2012-07-19 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 (2 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-20210024604-A1 NOVEL INSULIN DERIVATIVES GPR119, INSR, IRS1 KDM4E 4401/4885PTGS2 4410/4885RAB9A 2605/4885
US-20120184487-A1 INSULIN DERIVATIVES INSR, IRS1, GPR119 KDM4E 4480/4885PTGS2 4476/4885RAB9A 3215/4885

“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.