SCHEMBL27093791

SCHEMBL27093791

CC(C)CC(NC(=O)CCOCCOCCNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NC(CCC(=O)C=[N+]=[N-])C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 8/20 0.44
▸ TLR2 O60603 2/20 0.43
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL27093786 1.00 PTPN1 (0.44) PTPN1TLR2KMT2A
SCHEMBL29938640 0.94 PTPN1 (0.42) PTPN1TLR2KMT2A
SCHEMBL27094764 0.94 PTPN1 (0.44) PTPN1TLR2KMT2A
SCHEMBL27094763 0.94 PTPN1 (0.44) PTPN1TLR2KMT2A
SCHEMBL29938666 0.92 PTPN1 (0.41) PTPN1TLR2KMT2A
SCHEMBL29938443 0.87 PTPN1 (0.43) PTPN1TLR2KMT2A
SCHEMBL27093858 0.87 PTPN1 (0.52) PTPN1TLR2
SCHEMBL27093852 0.87 PTPN1 (0.52) PTPN1TLR2
SCHEMBL29938619 0.85 PTPN1 (0.41) PTPN1TLR2KMT2A
SCHEMBL29938658 0.84 PTPN1 (0.54) PTPN1

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
EP-4322961-A1 DENDRIMER-GLUTAMINE ANTAGONIST CONJUGATES AND METHODS OF USE THEREOF The Johns Hopkins University (US) 2024-02-21 — — EP disclosed
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