SCHEMBL23499028

SCHEMBL23499028

CCOC(=O)C(=O)c1c(C)c(C(=O)OCC)c(Br)n1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.54
USP2 O75604 1/20 0.51
HPGD P15428 5/20 0.41
TSHR P16473 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
MAPT P10636 3/20 0.40
GAA P10253 2/20 0.40
PKM P14618 1/20 0.40
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37

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
SCHEMBL21408305 0.84 KMT2A (0.76) KMT2AUSP2HPGDTSHRL3MBTL1
SCHEMBL21427861 0.82 KMT2A (0.54) KMT2AUSP2HPGDTSHRL3MBTL1
SCHEMBL16416778 0.75 KMT2A (0.76) KMT2AUSP2HPGDTSHRL3MBTL1
SCHEMBL22906154 0.74 KMT2A (0.51) KMT2AUSP2HPGDTSHRL3MBTL1
SCHEMBL21408348 0.72 USP2 (0.77) KMT2AUSP2HPGDTSHRL3MBTL1
SCHEMBL22307957 0.71 MAPK1 (0.50) KMT2AUSP2HPGDTSHRL3MBTL1
SCHEMBL11363402 0.70 KMT2A (1.00) KMT2AUSP2HPGDTSHRL3MBTL1
SCHEMBL392245 0.70 KMT2A (0.46) KMT2AUSP2HPGDTSHRL3MBTL1
SCHEMBL21427864 0.70 USP2 (0.55) KMT2AUSP2HPGDTSHRL3MBTL1
SCHEMBL16416948 0.69 USP2 (0.71) KMT2AUSP2HPGDTSHRL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230107941-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS VenatoRx Pharmaceuticals, Inc. 2023-04-06 US disclosed
WO-2021119081-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS VenatoRx Pharmaceuticals, Inc. (US) 2021-06-17 WO disclosed
WO-2021119081-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS VenatoRx Pharmaceuticals, Inc. (US) 2021-06-17 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-20230107941-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS HAVCR2, COPB1, HDLBP KMT2A 4016/4885USP2 891/4885HPGD 2439/4885

“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.