SCHEMBL20249133

SCHEMBL20249133

CC(C)(C)c1ccc(C2CCOCC2)cn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
HIF1A Q16665 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CHRNA7 P36544 3/20 0.34
KCNH2 Q12809 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
IL2 P60568 1/20 0.33
MAP4K1 Q92918 1/20 0.33
TGFB1 P01137 1/20 0.33
CFTR P13569 1/20 0.33
MAPK1 P28482 3/20 0.33
HTR1D P28221 1/20 0.32
SYK P43405 1/20 0.32
PIK3CA P42336 2/20 0.32

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
SCHEMBL15604151 0.88 KDM4E (0.39) SMN1; SMN2KDM4EGLAHTTKMT2A
SCHEMBL22388847 0.84 SMN1; SMN2 (0.47) SMN1; SMN2KDM4EGLAHTTKMT2A
SCHEMBL19625291 0.83 SMN1; SMN2 (0.50) SMN1; SMN2KDM4EGLAHTTKMT2A
SCHEMBL20469404 0.83 CHRNA7 (0.34) CHRNA7
SCHEMBL13141209 0.81 ESR2 (0.46) SMN1; SMN2KDM4EGLAHTTKMT2A
SCHEMBL11916023 0.80 HTR2C (0.45)
SCHEMBL20249182 0.80 ESR2 (0.46) SMN1; SMN2KDM4EGLAHTTKMT2A
SCHEMBL17998801 0.79 QDPR (0.45) KCNH2HRH3MAP4K1
SCHEMBL20249129 0.78 KMT2A (0.36) SMN1; SMN2KDM4EGLAHTTKMT2A
SCHEMBL19088565 0.77 TNKS (0.43) SMN1; SMN2KDM4EGLAHTTKMT2A

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-20230227429-A1 SULPHONAMIDE COMPOUNDS Anaxis Pharma Pty Ltd (AU) 2023-07-20 US disclosed
US-20180161329-A1 PYRIDO[3,4-D]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF TEIJIN PHARMA LIMITED (JP) 2018-06-14 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 (2 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-20180161329-A1 PYRIDO[3,4-D]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF CDK4, CDK6, CDK16 FAAH 4295/4885SMN1; SMN2 1690/4885KDM4E 470/4885
US-20230227429-A1 SULPHONAMIDE COMPOUNDS MLKL, RIPK3, CASP1 FAAH 3043/4885SMN1; SMN2 1484/4885KDM4E 1464/4885

“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.