SCHEMBL2537035

SCHEMBL2537035

CCOC(=O)C1(O)CCC2(CCCO2)CC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.33
ATM Q13315 1/20 0.33
LMNA P02545 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GPR119 Q8TDV5 2/20 0.32
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
ABCB11 O95342 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
ITGB1 P05556 1/20 0.31
ITGA4 P13612 1/20 0.31
ITGB7 P26010 1/20 0.31
OPRM1 P35372 3/20 0.31
OPRD1 P41143 2/20 0.30
OPRK1 P41145 2/20 0.30
SLC22A1 O15245 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
SCHEMBL542029 0.80
SCHEMBL3746243 0.79 ALDH1A1 (0.36) SMN1; SMN2LMNAALDH1A1HSD17B10GPR119
SCHEMBL24580648 0.78 ALDH1A1 (0.42) SMN1; SMN2ATMLMNAALDH1A1HSD17B10
SCHEMBL1815035 0.77 SMN1; SMN2 (0.41) SMN1; SMN2ATMLMNAALDH1A1HSD17B10
SCHEMBL5411525 0.77 SMN1; SMN2 (0.45) SMN1; SMN2ATMLMNAALDH1A1HSD17B10
SCHEMBL8198244 0.75 TSHR (0.44) SMN1; SMN2ATMLMNAALDH1A1HSD17B10
SCHEMBL3604706 0.75 SMN1; SMN2 (0.40) SMN1; SMN2ATMLMNAALDH1A1HSD17B10
SCHEMBL1153474 0.75 SMN1; SMN2 (0.40) SMN1; SMN2ATMLMNAALDH1A1HSD17B10
SCHEMBL1810872 0.75 SMN1; SMN2 (0.36) SMN1; SMN2ATMLMNAALDH1A1HSD17B10
SCHEMBL22898114 0.74 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1POLBMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2185563-B1 OXASPIROCYCLIC SPIRO-SUBSTITUTED TETRAMIC AND TETRONIC ACID DERIVATIVES BAYER IP GMBH (DE) 2015-08-19 EP disclosed
US-8859466-B2 Oxaspirocyclic spiro-substituted tetramic acid and tetronic acid derivatives BAYER CROPSCIENCE AG (DE) 2014-10-14 US disclosed
US-8859466-B2 Oxaspirocyclic spiro-substituted tetramic acid and tetronic acid derivatives BAYER CROPSCIENCE AG (DE) 2014-10-14 US disclosed
US-8859466-B2 Oxaspirocyclic spiro-substituted tetramic acid and tetronic acid derivatives BAYER CROPSCIENCE AG (DE) 2014-10-14 US disclosed
US-20110263424-A1 Oxaspirocyclic Spiro-Substituted Tetramic Acid and Tetronic Acid Derivatives BAYER CROPSCIENCE AG (DE) 2011-10-27 US disclosed
US-20110263424-A1 Oxaspirocyclic Spiro-Substituted Tetramic Acid and Tetronic Acid Derivatives BAYER CROPSCIENCE AG (DE) 2011-10-27 US disclosed
US-20110263424-A1 Oxaspirocyclic Spiro-Substituted Tetramic Acid and Tetronic Acid Derivatives BAYER CROPSCIENCE AG (DE) 2011-10-27 US disclosed
WO-2009015801-A1 OXASPIROCYCLIC SPIRO-SUBSTITUTED TETRAMIC AND TETRONIC ACID DERIVATIVES BAYER CROPSCIENCE AG (DE) 2009-02-05 WO disclosed
EP-2020413-A1 Oxaspirocyclical spiro-substituted tetram and tetron acid derivatives Bayer CropScience AG (DE) 2009-02-04 EP 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-20110263424-A1 Oxaspirocyclic Spiro-Substituted Tetramic Acid and Tetronic Acid Derivatives TBCA, POF1B, DDT SMN1; SMN2 3634/4885ATM 3803/4885LMNA 4169/4885

“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.