SCHEMBL30736232

SCHEMBL30736232

CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCS)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 14/20 0.65
▸ FNTB P49356 14/20 0.65
▸ PGGT1B P53609 13/20 0.65

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
SCHEMBL30736117 0.94 FNTA (0.64) FNTAFNTBPGGT1B
SCHEMBL30052897 0.85 KMT2A (0.63) FNTAFNTBPGGT1B
SCHEMBL29354807 0.85 OPRD1 (0.64) FNTAFNTBPGGT1B
SCHEMBL29453929 0.85 FNTA (0.60) FNTAFNTBPGGT1B
SCHEMBL11397444 0.84 OPRD1 (0.62) FNTAFNTBPGGT1B
SCHEMBL138411 0.84 OPRD1 (0.62) FNTAFNTBPGGT1B
SCHEMBL29388464 0.84 OPRD1 (0.62) FNTAFNTBPGGT1B
SCHEMBL1880497 0.84 OPRD1 (0.62) FNTAFNTBPGGT1B
SCHEMBL632433 0.84 OPRD1 (0.62) FNTAFNTBPGGT1B
SCHEMBL5812102 0.84 OPRD1 (0.62) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023247999-A1 PEPTIDIC PAIN MODULATORS AND METHODS FOR PRODUCING AND USING THE SAME MAINLINE BIOSCIENCES (SHANGHAI) CO., LTD. (CN) 2023-12-28 — — WO claimed
WO-2023247999-A1 PEPTIDIC PAIN MODULATORS AND METHODS FOR PRODUCING AND USING THE SAME MAINLINE BIOSCIENCES (SHANGHAI) CO., LTD. (CN) 2023-12-28 — — WO disclosed
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