SCHEMBL14656273

SCHEMBL14656273

COC(=O)C(C)C(C(C)=O)C(=O)OC

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
CA14 Q9ULX7 2/20 0.38
ALDH1A1 P00352 2/20 0.36
CA12 O43570 1/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 2/20 0.31
TSHR P16473 2/20 0.31
MEN1 O00255 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL11111473 0.87 SMN1; SMN2 (0.59) SMN1; SMN2CA14ALDH1A1CA12KMT2A
SCHEMBL11648465 0.86 SMN1; SMN2 (0.48) SMN1; SMN2CA14ALDH1A1CA12CYP3A4
SCHEMBL11422036 0.84 SMN1; SMN2 (0.60) SMN1; SMN2CA14ALDH1A1CA12CYP3A4
SCHEMBL856080 0.82 SMN1; SMN2 (0.61) SMN1; SMN2CA14ALDH1A1CA12CYP3A4
SCHEMBL13220417 0.82 SMN1; SMN2 (0.54) SMN1; SMN2CA14ALDH1A1CA12CYP3A4
SCHEMBL2855909 0.81 SMN1; SMN2 (0.57) SMN1; SMN2CA14ALDH1A1CA12CYP3A4
SCHEMBL4610375 0.81 SMN1; SMN2 (0.48) SMN1; SMN2CA14ALDH1A1CA12CYP3A4
SCHEMBL17953987 0.79 SMN1; SMN2 (0.44) SMN1; SMN2CA14ALDH1A1CA12CYP3A4
SCHEMBL12873399 0.79 SMN1; SMN2 (0.44) SMN1; SMN2CA14ALDH1A1CA12CYP3A4
SCHEMBL5799030 0.78 SMN1; SMN2 (0.56) SMN1; SMN2CA14ALDH1A1CA12CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130245286-A1 PROCESS FOR PRODUCING WINE LACTONE TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-09-19 US disclosed
US-20130245286-A1 PROCESS FOR PRODUCING WINE LACTONE TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-09-19 US disclosed
US-20130245287-A1 PROCESS FOR PRODUCING WINE LACTONE TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-09-19 US disclosed
US-20130245287-A1 PROCESS FOR PRODUCING WINE LACTONE TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-09-19 US disclosed
US-20130245287-A1 PROCESS FOR PRODUCING WINE LACTONE TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-09-19 US disclosed
US-20130245286-A1 PROCESS FOR PRODUCING WINE LACTONE TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-09-19 US disclosed
US-8481759-B2 Process for producing wine lactone TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-07-09 US disclosed
US-8481759-B2 Process for producing wine lactone TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-07-09 US disclosed
US-8481759-B2 Process for producing wine lactone TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-07-09 US disclosed
US-20130030193-A1 PROCESS FOR PRODUCING WINE LACTONE TAKASAGO INTERNATIONAL CORPORATION 2013-01-31 US disclosed
US-20130030193-A1 PROCESS FOR PRODUCING WINE LACTONE TAKASAGO INTERNATIONAL CORPORATION 2013-01-31 US disclosed
US-20130030193-A1 PROCESS FOR PRODUCING WINE LACTONE TAKASAGO INTERNATIONAL CORPORATION 2013-01-31 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 (3 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-20130245286-A1 PROCESS FOR PRODUCING WINE LACTONE SUCLA2, ADH5, PCCA SMN1; SMN2 3340/4885CA14 233/4885ALDH1A1 360/4885
US-20130245287-A1 PROCESS FOR PRODUCING WINE LACTONE SUCLA2, ADH5, PCCA SMN1; SMN2 3340/4885CA14 233/4885ALDH1A1 360/4885
US-20130030193-A1 PROCESS FOR PRODUCING WINE LACTONE SUCLA2, ADH5, PCCA SMN1; SMN2 3340/4885CA14 233/4885ALDH1A1 360/4885

“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.