SCHEMBL17665038

SCHEMBL17665038

CC(C)(C)OC(=O)NCC(=O)NCC(=O)NCC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.48
▸ EPHX2 P34913 1/20 0.43
▸ MALT1 Q9UDY8 1/20 0.40
▸ NPFFR1 Q9GZQ6 1/20 0.39
▸ NPFFR2 Q9Y5X5 1/20 0.39
▸ FABP7 O15540 1/20 0.39
▸ FABP5 Q01469 1/20 0.39
▸ MDM2 Q00987 1/20 0.39
▸ CASP3 P42574 1/20 0.39

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
SCHEMBL18982241 0.95 KMT2A (0.49) KMT2AEPHX2MALT1FABP7FABP5
SCHEMBL27072523 0.91 KMT2A (0.51) KMT2AEPHX2CASP3
SCHEMBL26352259 0.91 KMT2A (0.51) KMT2AEPHX2CASP3
SCHEMBL30099527 0.90 KMT2A (0.53) KMT2AEPHX2MALT1NPFFR1NPFFR2
SCHEMBL19931854 0.85 KMT2A (0.54) KMT2AEPHX2CASP3
SCHEMBL29616475 0.85 KMT2A (0.54) KMT2AEPHX2CASP3
SCHEMBL16006885 0.84 KMT2A (0.46) KMT2AEPHX2MALT1MDM2CASP3
SCHEMBL29400357 0.84 KMT2A (0.54) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL22860768 0.84 KMT2A (0.54) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL17665039 0.83 KMT2A (0.62) KMT2AEPHX2FABP7FABP5CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11732038-B2 Conjugates comprising cell-binding agents and cytotoxic agents IMMUNOGEN, INC. (US) 2023-08-22 — — US disclosed
US-20210299271-A1 CONJUGATES COMPRISING CELL-BINDING AGENTS AND CYTOTOXIC AGENTS IMMUNOGEN, INC. 2021-09-30 — — US disclosed
US-10988531-B2 Conjugates comprising cell-binding agents and cytotoxic agents IMMUNOGEN, INC. (US) 2021-04-27 — — US disclosed
EP-3188733-B1 CONJUGATES COMPRISING CELL-BINDING AGENTS AND CYTOTOXIC AGENTS IMMUNOGEN INC (US) 2019-11-06 — — EP disclosed
US-20160095938-A1 CONJUGATES COMPRISING CELL-BINDING AGENTS AND CYTOTOXIC AGENTS IMMUNOGEN, INC. 2016-04-07 — — 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 (4 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-11732038-B2 Conjugates comprising cell-binding agents and cytotoxic agents PCNA, EPCAM, MKI67 KMT2A 634/4885EPHX2 124/4885MALT1 1122/4885
US-10988531-B2 Conjugates comprising cell-binding agents and cytotoxic agents PCNA, EPCAM, MKI67 KMT2A 634/4885EPHX2 124/4885MALT1 1122/4885
US-20160095938-A1 CONJUGATES COMPRISING CELL-BINDING AGENTS AND CYTOTOXIC AGENTS PCNA, EPCAM, MKI67 KMT2A 634/4885EPHX2 124/4885MALT1 1122/4885
US-20210299271-A1 CONJUGATES COMPRISING CELL-BINDING AGENTS AND CYTOTOXIC AGENTS PCNA, EPCAM, MKI67 KMT2A 634/4885EPHX2 124/4885MALT1 1122/4885

“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.

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