SCHEMBL7904872

SCHEMBL7904872

CCCc1onc(OCCO)c1C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.32
PTGS2 P35354 1/20 0.32
GPBAR1 Q8TDU6 1/20 0.30
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 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
SCHEMBL7901543 0.88 LMNA (0.33) LMNAPTGS2GPBAR1MEN1GAA
SCHEMBL12545589 0.82 HTT (0.31)
SCHEMBL17244584 0.79 MEN1 (0.45) LMNAMEN1GAAKMT2A
SCHEMBL12545279 0.75 LMNA (0.33) LMNAMEN1GAAKMT2A
SCHEMBL16301784 0.64 L3MBTL1 (0.39) LMNAPTGS2GAA
SCHEMBL9392519 0.62 PTGS1 (0.48) LMNAMEN1GAAKMT2A
SCHEMBL5764953 0.62 POLB (0.44) GAAKMT2A
Hydrochloric Acid SCHEMBL8377423 0.60 PTGS1 (0.43) LMNAMEN1GAAKMT2A
SCHEMBL31327214 0.60 MKNK2 (0.39) LMNAGAAKMT2A
SCHEMBL6612159 0.60 POLB (0.46) GPBAR1MEN1GAAKMT2A

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-20110135650-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-06-09 US disclosed
WO-2010065717-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-06-10 WO 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-20110135650-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS SERPINC1, F9, F8 LMNA 95/4885PTGS2 2450/4885GPBAR1 3877/4885

“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.