SCHEMBL29692555

SCHEMBL29692555

CC(C)C[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)O)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NTSR2 O95665 3/20 0.40
▸ NTSR1 P30989 3/20 0.40
▸ ELANE P08246 2/20 0.40
▸ CAPN1 P07384 4/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ XIAP P98170 1/20 0.40
▸ CTSB P07858 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ STAT3 P40763 3/20 0.38
▸ CMA1 P23946 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
SCHEMBL29567235 0.91 NTSR1 (0.40) NTSR2NTSR1ELANECAPN1CTSB
SCHEMBL29875130 0.91 ELANE (0.40) NTSR2NTSR1ELANECAPN1XIAP
SCHEMBL29567365 0.91 NTSR1 (0.40) NTSR2NTSR1ELANECAPN1CTSB
SCHEMBL29566935 0.90 OPRD1 (0.41) NTSR2NTSR1ELANECAPN1CTSB
SCHEMBL29411315 0.89 XIAP (0.42) ELANESLC6A2XIAPCMA1
SCHEMBL1371146 0.89 ELANE (0.42) ELANEXIAPCMA1
SCHEMBL1371152 0.89 ELANE (0.42) ELANEXIAPCMA1
SCHEMBL29568037 0.89 CAPN1 (0.42) NTSR2NTSR1ELANECAPN1CTSB
SCHEMBL29567081 0.88 ELANE (0.38) NTSR2NTSR1ELANECAPN1XIAP
SCHEMBL29411290 0.88 DPP4 (0.43) NTSR2NTSR1ELANEXIAPCMA1

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
EP-4017541-A1 IMMUNE TOLERANT ELASTIN-LIKE RECOMBINANT PEPTIDES AND METHODS OF USE University of Utah Research Foundation (US) 2022-06-29 — — EP claimed
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