SCHEMBL29377155

SCHEMBL29377155

CSCC[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C(C)C

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 14/20 0.49
▸ FNTB P49356 14/20 0.49
▸ PGGT1B P53609 3/20 0.41
▸ BACE1 P56817 4/20 0.38

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
SCHEMBL31632214 0.93 FNTA (0.48) FNTAFNTBPGGT1BBACE1
SCHEMBL31239703 0.92 FNTA (0.49) FNTAFNTBPGGT1BBACE1
SCHEMBL30567410 0.87 BACE1 (0.38) FNTAFNTBBACE1
SCHEMBL2549584 0.87 FNTA (0.47) FNTAFNTBPGGT1B
SCHEMBL30254038 0.87 BACE1 (0.38) FNTAFNTBBACE1
SCHEMBL8994183 0.87 FNTA (0.47) FNTAFNTBPGGT1B
SCHEMBL7050635 0.87 FNTA (0.47) FNTAFNTBPGGT1B
SCHEMBL29590286 0.87 FNTA (0.43) FNTAFNTBPGGT1BBACE1
SCHEMBL31107069 0.87 FNTA (0.47) FNTAFNTBPGGT1BBACE1
SCHEMBL29531539 0.86 BACE1 (0.41) BACE1

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-20220128556-A1 METHODS OF DIAGNOSING DISEASE 4D Pharma Cork Limited (IE) 2022-04-28 — — US disclosed
CN-114040986-A Method of diagnosing disease 4D制药科克有限公司 2022-02-11 — — CN disclosed
EP-3947743-A1 METHODS OF DIAGNOSING DISEASE 4D Pharma Cork Limited (IE) 2022-02-09 — — EP disclosed
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