SCHEMBL24937256

SCHEMBL24937256

CCOC(=O)c1c(C)cn(COCCS(C)(C)C)c1C=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
CYP3A4 P08684 2/20 0.40
USP2 O75604 1/20 0.40
MAPT P10636 7/20 0.36
ALDH1A1 P00352 5/20 0.36
NPSR1 Q6W5P4 4/20 0.36
LMNA P02545 3/20 0.36
HTT P42858 1/20 0.35
KMT2A Q03164 4/20 0.33
GAA P10253 2/20 0.33
HPGD P15428 1/20 0.33
POLB P06746 1/20 0.33
MEN1 O00255 3/20 0.33
RAB9A P51151 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
HSP90AA1 P07900 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33

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
SCHEMBL24937259 0.88 SMN1; SMN2 (0.39) SMN1; SMN2CYP3A4USP2MAPTALDH1A1
SCHEMBL23123688 0.83 CYP3A4 (0.37) SMN1; SMN2CYP3A4USP2MAPTALDH1A1
SCHEMBL24936579 0.79 TSHR (0.37) SMN1; SMN2MAPTALDH1A1NPSR1LMNA
SCHEMBL27077700 0.76 ALDH1A1 (0.47) SMN1; SMN2CYP3A4USP2MAPTALDH1A1
SCHEMBL23122981 0.72 DGAT1 (0.35) SMN1; SMN2CYP3A4USP2MAPTALDH1A1
SCHEMBL29987804 0.72 ALDH1A1 (0.43) SMN1; SMN2CYP3A4USP2MAPTALDH1A1
SCHEMBL21266229 0.70 GAA (0.39) SMN1; SMN2MAPTALDH1A1NPSR1GAA
SCHEMBL19149856 0.70 HTT (0.34) SMN1; SMN2MAPTALDH1A1NPSR1HTT
SCHEMBL19149345 0.68 GABRA2 (0.32) SMN1; SMN2MAPTALDH1A1HTTKMT2A
SCHEMBL18676310 0.68 LMNA (0.35) SMN1; SMN2MAPTALDH1A1LMNAHTT

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-20230028114-A1 AZOLE-FUSED PYRIDAZIN-3(2H)-ONE DERIVATIVES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-01-26 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-20230028114-A1 AZOLE-FUSED PYRIDAZIN-3(2H)-ONE DERIVATIVES GPR139, GPR119, GPR39 SMN1; SMN2 2406/4885CYP3A4 1477/4885USP2 4026/4885

“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.