SCHEMBL19829782

SCHEMBL19829782

COc1ccc(C(=O)C[C@@]2(O)C(=O)Nc3c(Cl)ccc(Cl)c32)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FLI1 Q01543 5/20 1.00
EWSR1 Q01844 5/20 1.00
ERG P11308 1/20 1.00
ETV1 P50549 1/20 1.00
MMP2 P08253 5/20 0.64
MMP9 P14780 5/20 0.64
MMP8 P22894 5/20 0.64
ALDH1A1 P00352 3/20 0.62
KMT2A Q03164 2/20 0.62
MEN1 O00255 1/20 0.62
HTT P42858 1/20 0.62
NPSR1 Q6W5P4 1/20 0.62
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CBX7 O95931 1/20 0.47
CDYL Q9Y232 1/20 0.47
TP53 P04637 1/20 0.45
GSK3B P49841 1/20 0.42

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
SCHEMBL19829781 1.00 FLI1 (1.00) FLI1EWSR1ERGETV1MMP2
SCHEMBL29399443 1.00 FLI1 (1.00) FLI1EWSR1ERGETV1MMP2
SCHEMBL3486735 1.00 FLI1 (1.00) FLI1EWSR1ERGETV1MMP2
SCHEMBL29810794 0.91 FLI1 (0.83) FLI1EWSR1ERGETV1MMP2
SCHEMBL17679820 0.91 FLI1 (0.83) FLI1EWSR1ERGETV1MMP2
SCHEMBL17669251 0.91 FLI1 (0.83) FLI1EWSR1ERGETV1MMP2
SCHEMBL17679823 0.91 FLI1 (0.83) FLI1EWSR1ERGETV1MMP2
SCHEMBL15337311 0.89 FLI1 (0.80) FLI1EWSR1ERGETV1MMP2
SCHEMBL19419557 0.88 FLI1 (0.78) FLI1EWSR1ERGETV1MMP2
SCHEMBL15337268 0.88 FLI1 (0.78) FLI1EWSR1ERGETV1MMP2

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-20180028495-A1 USES OF INDOLINONE COMPOUNDS GEORGETOWN UNIVERSITY 2018-02-01 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-20180028495-A1 USES OF INDOLINONE COMPOUNDS MCL1, BCL3, BCL9 FLI1 8/4885EWSR1 823/4885ERG 311/4885

“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.