SCHEMBL4107178

SCHEMBL4107178

CCOC(=O)/C=C/C(=O)Oc1c(C)occc1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 5/20 0.44
MAPT P10636 5/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
HTT P42858 1/20 0.44
ATM Q13315 1/20 0.44
GAA P10253 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
HCAR2 Q8TDS4 1/20 0.41
TTR P02766 1/20 0.40
DPP4 P27487 1/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.39
MDM2 Q00987 1/20 0.39

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
SCHEMBL4107182 1.00 SMN1; SMN2 (0.46) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL4112804 0.85 SMN1; SMN2 (0.40) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL4112796 0.85 SMN1; SMN2 (0.40) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL15797772 0.78 CA12 (0.51) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL15797717 0.78 CA12 (0.51) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL1532533 0.77 SMN1; SMN2 (0.51) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL15805563 0.77 MAPT (0.56) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL1845901 0.75 SMN1; SMN2 (0.55) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL1843245 0.75 SMN1; SMN2 (0.49) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL8342115 0.74 CA12 (0.53) MAPTCA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090047223-A1 Improvements in or Related to Organic Compoounds GIVAUDAN SA (CH) 2009-02-19 US claimed
US-20090047223-A1 Improvements in or Related to Organic Compoounds GIVAUDAN SA (CH) 2009-02-19 US disclosed
EP-1966117-A1 IMPROVEMENTS IN OR RELATED TO ORGANIC COMPOUNDS Givaudan SA (CH) 2008-09-10 EP disclosed
WO-2007071085-A1 IMPROVEMENTS IN OR RELATED TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2007-06-28 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-20090047223-A1 Improvements in or Related to Organic Compoounds LPO, OTC, OAT SMN1; SMN2 1471/4885LMNA 4030/4885MAPT 3152/4885

“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.