SCHEMBL30919312

SCHEMBL30919312

CC(C)OC(=O)[C@H](CCC(=O)N[C@@H](CCC(=O)C=[N+]=[N-])C(=O)N[C@@H](CCC(=O)C=[N+]=[N-])C(=O)OC(C)C)NC(=O)CNC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 7/20 0.41
▸ TLR2 O60603 3/20 0.40
▸ KMT2A Q03164 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
SCHEMBL30919318 0.94 PTPN1 (0.46) PTPN1TLR2
SCHEMBL30919311 0.90 PTPN1 (0.46) PTPN1TLR2
SCHEMBL30919277 0.88 TLR2 (0.38) PTPN1TLR2KMT2A
SCHEMBL26262664 0.86 TLR2 (0.45) PTPN1TLR2KMT2A
SCHEMBL29676672 0.86 TLR2 (0.45) PTPN1TLR2KMT2A
SCHEMBL18452864 0.86 TLR2 (0.45) PTPN1TLR2KMT2A
SCHEMBL30948810 0.86 TLR2 (0.42) PTPN1TLR2KMT2A
SCHEMBL29938622 0.85 PTPN1 (0.49) PTPN1TLR2
SCHEMBL18452568 0.85 PTPN1 (0.49) PTPN1TLR2
SCHEMBL29938640 0.85 PTPN1 (0.42) PTPN1TLR2KMT2A

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
EP-4612124-A1 AZOTOMYCIN PRODRUGS WITH PREFERENTIAL TUMOR DELIVERY The Johns Hopkins University (US) 2025-09-10 — — EP disclosed
WO-2024097320-A1 AZOTOMYCIN PRODRUGS WITH PREFERENTIAL TUMOR DELIVERY THE JOHNS HOPKINS UNIVERSITY (US) 2024-05-10 — — WO disclosed
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