SCHEMBL733974

SCHEMBL733974

COCCC1CCC2(CC1)OC(=O)C(c1c(C)cc(C)cc1C)=C2O

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TSHR P16473 2/20 0.31
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
AKR1C3 P42330 1/20 0.31
MAPT P10636 1/20 0.31
MEN1 O00255 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
SCHEMBL734041 0.83 KMT2A (0.33) KMT2ASMN1; SMN2
SCHEMBL11989359 0.82 ACACB (0.35) KMT2ASMN1; SMN2TSHRACACBACACA
SCHEMBL732395 0.82 KMT2A (0.30) KMT2ASMN1; SMN2
SCHEMBL782597 0.81 POLB (0.31) TSHR
SCHEMBL30737090 0.81 TSHR (0.36) TSHRMAPT
SCHEMBL12460545 0.79 ACACB (0.38) TSHRACACBACACAMAPT
SCHEMBL27374303 0.79 TSHR (0.33) TSHRMAPT
SCHEMBL731855 0.79 ACACB (0.34) TSHRACACBACACA
SCHEMBL13039853 0.78 TSHR (0.32) TSHR
SCHEMBL11986867 0.78 TSHR (0.39) TSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1943218-B1 ALKOXYALKYL SPIROCYCLIC TETRAMIC ACIDS AND TETRONIC ACIDS BAYER IP GMBH (DE) 2015-05-06 EP disclosed
US-8138119-B2 Alkoxyalkyl spirocyclic tetramic acids and tetronic acids BAYER CROPSCIENCE AG (DE) 2012-03-20 US disclosed
US-8138119-B2 Alkoxyalkyl spirocyclic tetramic acids and tetronic acids BAYER CROPSCIENCE AG (DE) 2012-03-20 US disclosed
US-20090215624-A1 Alkoxyalkyl Spirocyclic Tetramic Acids and Tetronic Acids BAYER CROPSCIENCE AG (DE) 2009-08-27 US disclosed
US-20090215624-A1 Alkoxyalkyl Spirocyclic Tetramic Acids and Tetronic Acids BAYER CROPSCIENCE AG (DE) 2009-08-27 US disclosed
WO-2007048545-A2 ALKOXYALKYL SPIROCYCLIC TETRAMIC ACIDS AND TETRONIC ACIDS BAYER CROPSCIENCE AG (DE) 2007-05-03 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-20090215624-A1 Alkoxyalkyl Spirocyclic Tetramic Acids and Tetronic Acids DDT, TBCD, TBCA KMT2A 3720/4885SMN1; SMN2 4266/4885TSHR 564/4885

“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.