SCHEMBL23281037

SCHEMBL23281037

CCOC(=O)[C@H](CCCCNC(=O)COCC(=O)O)NC(=O)CCCCCN=[N+]=[N-]

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.49
▸ KMT2A Q03164 2/20 0.46
▸ NOD1 Q9Y239 3/20 0.42
▸ POLB P06746 1/20 0.41
▸ FOLH1 Q04609 5/20 0.39

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
SCHEMBL21602829 0.82 KMT2A (0.46) KMT2ANOD1POLBFOLH1
SCHEMBL23280888 0.80 CAPN1 (0.44) KMT2APOLB
SCHEMBL31384226 0.79 NOD1 (0.41) GLP1RKMT2ANOD1FOLH1
SCHEMBL23280953 0.79 KMT2A (0.52) KMT2ANOD1POLBFOLH1
SCHEMBL23280889 0.76 NOD1 (0.43) KMT2ANOD1
SCHEMBL21602778 0.76 GLP1R (0.43) GLP1RKMT2ANOD1POLB
SCHEMBL31384213 0.76 NOD1 (0.52) GLP1RNOD1FOLH1
SCHEMBL16247361 0.75 KMT2A (0.62) GLP1RKMT2ANOD1POLB
SCHEMBL3691278 0.75 KMT2A (0.62) GLP1RKMT2ANOD1POLB
SCHEMBL7605823 0.75 KMT2A (0.62) GLP1RKMT2ANOD1POLB

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-3812376-A1 PACLITAXEL-LIPID-POLYSACCHARIDE DUAL-TYPE CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF Santolecan Pharmaceuticals LLC (US) 2021-04-28 — — EP disclosed
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