SCHEMBL29928265

SCHEMBL29928265

C=CCOc1cc(OCOC)cc(O)c1C(C)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.49
USP2 O75604 1/20 0.49
MAPK1 P28482 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
SLC5A1 P13866 1/20 0.41
SLC5A2 P31639 1/20 0.41
FLT3 P36888 1/20 0.39
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
ABL1 P00519 1/20 0.38
POLB P06746 1/20 0.38
RECQL P46063 1/20 0.38
RIN1 Q13671 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.36
ALDH1A1 P00352 2/20 0.36
PTPN1 P18031 3/20 0.35

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
SCHEMBL12375337 0.90 CYP3A4 (0.51) CYP3A4USP2MAPK1SMN1; SMN2SLC5A1
SCHEMBL656327 0.87 CYP3A4 (0.58) CYP3A4USP2MAPK1SMN1; SMN2KDM4E
SCHEMBL30792317 0.87 CYP3A4 (0.58) CYP3A4USP2MAPK1SMN1; SMN2KDM4E
SCHEMBL10963506 0.85 CYP3A4 (0.65) CYP3A4USP2MAPK1SMN1; SMN2SLC5A1
SCHEMBL7893039 0.81 CYP3A4 (0.55) CYP3A4USP2MAPK1SMN1; SMN2SLC5A1
SCHEMBL22465738 0.80 ABCG2 (0.59) CYP3A4USP2MAPK1SLC5A1SLC5A2
SCHEMBL26481061 0.80 CYP3A4 (0.71) CYP3A4USP2MAPK1SMN1; SMN2KDM4E
SCHEMBL30350587 0.80 CYP3A4 (0.71) CYP3A4USP2MAPK1SMN1; SMN2KDM4E
SCHEMBL30792196 0.80 ABCG2 (0.41) CYP3A4USP2MAPK1SMN1; SMN2SLC5A1
SCHEMBL1939998 0.79 KDM4E (0.48) CYP3A4USP2MAPK1SMN1; SMN2FLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11479537-B2 T-type calcium channel inhibitor KINKI UNIVERSITY (JP) 2022-10-25 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 (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-11479537-B2 T-type calcium channel inhibitor CACNA1H, CACNA1I, CACNA1G CYP3A4 2884/4885USP2 4322/4885MAPK1 1210/4885

“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.