SCHEMBL24450930

SCHEMBL24450930

CCc1cn(CCOCCOCCOCCC(C)=O)nn1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 4/20 0.39
DRD2 P14416 5/20 0.39
MMP2 P08253 2/20 0.38
MMP9 P14780 2/20 0.38
MMP8 P22894 2/20 0.38
MMP13 P45452 2/20 0.38
GBA1 P04062 1/20 0.38
NCF1 P14598 4/20 0.37
CACNA1F O60840 3/20 0.36
ABCB1 P08183 3/20 0.36
CACNA1D Q01668 3/20 0.36
CACNA1S Q13698 3/20 0.36
CACNA1C Q13936 3/20 0.36
CYBB P04839 1/20 0.36
NOX5 Q96PH1 1/20 0.36
DRD4 P21917 2/20 0.36
DRD3 P35462 2/20 0.36

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
SCHEMBL27269271 0.99 GBA1 (0.39) DGAT1DRD2MMP2MMP9MMP8
SCHEMBL17776308 0.89 DGAT1 (0.48) DGAT1MMP2MMP9MMP8MMP13
SCHEMBL17776309 0.87 CSNK2A1 (0.41) DGAT1DRD2MMP2MMP9MMP8
SCHEMBL24894084 0.86 EPHX2 (0.51) DRD2GBA1
SCHEMBL24916753 0.85 EPHX2 (0.53) DRD2GBA1
SCHEMBL23194394 0.84 DRD2 (0.39) DGAT1DRD2MMP2MMP9MMP8
SCHEMBL18768818 0.84 EPHX2 (0.46) DRD2
SCHEMBL18770918 0.84 DRD2 (0.42) DGAT1DRD2MMP2MMP9MMP8
SCHEMBL16234065 0.84 CSNK2A1 (0.40) GBA1
SCHEMBL21537936 0.83 DGAT1 (0.45) DGAT1MMP2MMP9MMP8MMP13

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-20220160887-A1 PROGRAMMABLE POLYMERIC DRUGS Sony Group Corporation (JP) 2022-05-26 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-20220160887-A1 PROGRAMMABLE POLYMERIC DRUGS CHRM1, NCL, PBRM1 DGAT1 4804/4885DRD2 1217/4885MMP2 1929/4885

“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.