SCHEMBL9068050

SCHEMBL9068050

CC[C@H](C)[C@H](CN(Cc1ccccc1)[C@H](C)C(=O)N[C@@H](CCSC)C(=O)O)NC[C@@H](N)CS

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 10/20 0.61
▸ FNTB P49356 10/20 0.61
▸ PGGT1B P53609 7/20 0.61

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
SCHEMBL9068229 1.00 FNTA (0.61) FNTAFNTBPGGT1B
SCHEMBL9068316 1.00 FNTA (0.61) FNTAFNTBPGGT1B
SCHEMBL9068335 1.00 FNTA (0.61) FNTAFNTBPGGT1B
SCHEMBL9067814 0.94 FNTA (0.58) FNTAFNTBPGGT1B
SCHEMBL9068009 0.93 FNTA (0.53) FNTAFNTBPGGT1B
SCHEMBL9067429 0.93 FNTA (0.53) FNTAFNTBPGGT1B
SCHEMBL9068217 0.93 FNTA (0.53) FNTAFNTBPGGT1B
SCHEMBL9068434 0.93 FNTA (0.53) FNTAFNTBPGGT1B
SCHEMBL9067877 0.92 FNTA (0.62) FNTAFNTBPGGT1B
SCHEMBL9068151 0.86 FNTA (0.50) FNTAFNTBPGGT1B

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-5536750-A ANTITUMOR MERCK & CO., INC. (US) 1996-07-16 — — US disclosed
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