SCHEMBL19019831

SCHEMBL19019831

CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)C(=O)CF

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MALT1 Q9UDY8 1/20 0.52
▸ EPHA2 P29317 2/20 0.47
▸ CMA1 P23946 4/20 0.47
▸ ELANE P08246 1/20 0.46
▸ OPRM1 P35372 6/20 0.45
▸ OPRK1 P41145 6/20 0.45
▸ NMUR2 Q9GZQ4 1/20 0.43
▸ NMUR1 Q9HB89 1/20 0.43
▸ REN P00797 2/20 0.43
▸ DPP4 P27487 1/20 0.42
▸ DPP8 Q6V1X1 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
SCHEMBL22209394 0.93 MALT1 (0.60) MALT1EPHA2CMA1ELANEOPRM1
SCHEMBL18619548 0.93 MALT1 (0.60) MALT1EPHA2CMA1ELANEOPRM1
SCHEMBL22209365 0.88 MALT1 (0.64) MALT1EPHA2CMA1ELANE
SCHEMBL18621052 0.88 MALT1 (0.64) MALT1EPHA2CMA1ELANE
SCHEMBL22811073 0.88 MALT1 (0.64) MALT1EPHA2CMA1ELANE
SCHEMBL18619572 0.88 MALT1 (0.64) MALT1EPHA2CMA1ELANE
SCHEMBL22209378 0.86 MALT1 (0.61) MALT1EPHA2CMA1ELANEDPP4
SCHEMBL18619579 0.86 MALT1 (0.61) MALT1EPHA2CMA1ELANE
SCHEMBL22209379 0.85 MALT1 (0.61) MALT1EPHA2CMA1ELANE
SCHEMBL29872221 0.84 DPP4 (0.52) MALT1EPHA2OPRM1OPRK1NMUR2

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-11884708-B2 Stapled peptide inhibitors of nemo as potential anti-inflammatory and anti-cancer drugs INSTITUT PASTEUR (FR) 2024-01-30 — — US disclosed
US-20220025002-A1 STAPLED PEPTIDE INHIBITORS OF NEMO AS POTENTIAL ANTI-INFLAMMATORY AND ANTI-CANCER DRUGS INSTITUT PASTEUR (FR) 2022-01-27 — — US disclosed
US-11149070-B2 Stapled peptide inhibitors of NEMO as potential anti-inflammatory and anti-cancer drugs INSTITUT PASTEUR (FR) 2021-10-19 — — US disclosed
EP-3394088-B1 STAPLED PEPTIDE INHIBITORS OF NEMO AS POTENTIAL ANTI-INFLAMMATORY AND ANTI-CANCER DRUGS PASTEUR INSTITUT (FR) 2020-08-05 — — EP disclosed
EP-3184541-A1 STAPLED PEPTIDE INHIBITORS OF NEMO AS POTENTIAL ANTI-INFLAMMATORY AND ANTI-CANCER DRUGS Institut Pasteur (FR) 2017-06-28 — — EP disclosed
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