SCHEMBL13554242

SCHEMBL13554242

[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Oc1cc(B(O)O)ccc1Cl

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.39
TTR P02766 2/20 0.34
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
HPGD P15428 1/20 0.30
ALOX12 P18054 1/20 0.30
MAPK1 P28482 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL13554248 0.83 ENPP2 (0.31) ENPP2
SCHEMBL13554239 0.77 RXRA (0.33) ENPP2
SCHEMBL29956646 0.76 ENPP2 (0.46) ENPP2TTRALDH1A1POLBMAPT
SCHEMBL2854999 0.76 ENPP2 (0.46) ENPP2TTRALDH1A1POLBMAPT
SCHEMBL29953019 0.73 CSNK2A1 (0.44) ENPP2TTRMEN1USP2ALDH1A1
SCHEMBL4881084 0.73 CSNK2A1 (0.44) ENPP2TTRMEN1USP2ALDH1A1
SCHEMBL23363515 0.72 ENPP2 (0.43) ENPP2TTRMEN1USP2ALDH1A1
SCHEMBL2561475 0.72 L3MBTL1 (0.46) ENPP2TTRMEN1USP2ALDH1A1
SCHEMBL29956963 0.72 ENPP2 (0.43) ENPP2TTRMEN1USP2ALDH1A1
SCHEMBL29956752 0.72 ENPP2 (0.43) ENPP2TTRMEN1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120270838-A1 SPIROIMIDAZOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-10-25 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-20120270838-A1 SPIROIMIDAZOLONE DERIVATIVE WNK3, REN, SGK3 ENPP2 4417/4885TTR 3663/4885MEN1 276/4885

“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.