SCHEMBL29616823

SCHEMBL29616823

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

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NMT1 P30419 6/20 0.51
▸ NMT2 O60551 5/20 0.51
▸ FOLH1 Q04609 1/20 0.46
▸ OPRL1 P41146 6/20 0.44
▸ TLR2 O60603 1/20 0.41
▸ TFPI P10646 1/20 0.40
▸ QRFPR Q96P65 1/20 0.40

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
SCHEMBL29601799 1.00 NMT1 (0.51) NMT1NMT2FOLH1OPRL1TLR2
SCHEMBL30608545 0.95 NMT1 (0.52) NMT1NMT2OPRL1TLR2TFPI
SCHEMBL31676539 0.91 NMT1 (0.51) NMT1NMT2FOLH1OPRL1TLR2
SCHEMBL31676627 0.91 NMT1 (0.51) NMT1NMT2FOLH1OPRL1TLR2
SCHEMBL31757269 0.88 NMT1 (0.51) NMT1NMT2FOLH1TLR2QRFPR
SCHEMBL31676643 0.87 FOLH1 (0.51) NMT1NMT2FOLH1OPRL1
SCHEMBL31676644 0.87 FOLH1 (0.51) NMT1NMT2FOLH1OPRL1
SCHEMBL31676623 0.87 FOLH1 (0.51) NMT1NMT2FOLH1OPRL1
SCHEMBL30397555 0.87 NMT1 (0.53) NMT1NMT2TLR2QRFPR
SCHEMBL30398397 0.87 NMT1 (0.53) NMT1NMT2TLR2QRFPR

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
WO-2022121040-A1 PEPTIDE MAPPING METHOD 佛山汉腾生物科技有限公司 2022-06-16 — — WO disclosed
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