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SCHEMBL31121552

SCHEMBL31121552

C[C@@H](O)[C@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)CN)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 5/20 0.39
▸ PRMT1 Q99873 1/20 0.37
▸ OPRM1 P35372 3/20 0.37
▸ OPRD1 P41143 3/20 0.37
▸ PDCD1LG2 Q9BQ51 1/20 0.36
▸ CD274 Q9NZQ7 1/20 0.36
▸ TGFBR1 P36897 3/20 0.36
▸ OPRK1 P41145 1/20 0.35
▸ QRFPR Q96P65 1/20 0.35
▸ OPRL1 P41146 2/20 0.34
▸ TERT O14746 1/20 0.33

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
SCHEMBL29892461 1.00 MME (0.39) MMEPRMT1OPRM1OPRD1PDCD1LG2
SCHEMBL29876444 1.00 MME (0.39) MMEPRMT1OPRM1OPRD1PDCD1LG2
SCHEMBL29473532 1.00 MME (0.39) MMEPRMT1OPRM1OPRD1PDCD1LG2
SCHEMBL30593912 0.90 OPRM1 (0.43) MMEPRMT1OPRM1OPRD1PDCD1LG2
SCHEMBL31031477 0.85 ALDH1A1 (0.41) MMETERT
SCHEMBL6749006 0.85 TGFBR1 (0.42) MMEOPRM1OPRD1TGFBR1QRFPR
SCHEMBL31187165 0.85 TGFBR1 (0.42) MMEOPRM1OPRD1TGFBR1QRFPR
SCHEMBL17874144 0.85 TGFBR1 (0.42) MMEOPRM1OPRD1TGFBR1QRFPR
SCHEMBL6749004 0.85 TGFBR1 (0.42) MMEOPRM1OPRD1TGFBR1QRFPR
SCHEMBL1635449 0.85 TGFBR1 (0.42) MMEOPRM1OPRD1TGFBR1QRFPR

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
CN-118679180-A Polypeptides comprising D-domains and uses thereof 阿奇利克斯股份有限公司 2024-09-20 — — CN disclosed
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