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SCHEMBL16465619

SCHEMBL16465619

CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)O)C(=O)O.CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)OC)C(=O)OC

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 10/20 0.63
▸ PLA2G2C Q5R387 1/20 0.56
▸ KMT2A Q03164 2/20 0.54
▸ PLA2G10 O15496 2/20 0.52
▸ SLC6A5 Q9Y345 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ GLP1R P43220 1/20 0.46

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
SCHEMBL8620768 0.91 NOD1 (0.61) NOD1PLA2G2CKMT2APLA2G10POLB
SCHEMBL5025135 0.91 NOD1 (0.61) NOD1PLA2G2CKMT2APLA2G10POLB
SCHEMBL8620766 0.91 NOD1 (0.61) NOD1PLA2G2CKMT2APLA2G10POLB
SCHEMBL7208303 0.91 KMT2A (0.64) NOD1PLA2G2CKMT2APLA2G10POLB
SCHEMBL7761870 0.91 KMT2A (0.64) NOD1PLA2G2CKMT2APLA2G10POLB
SCHEMBL9743924 0.91 NOD1 (0.61) NOD1PLA2G2CKMT2APLA2G10POLB
SCHEMBL17446733 0.91 NOD1 (0.61) NOD1PLA2G2CKMT2APLA2G10POLB
SCHEMBL18796603 0.91 NOD1 (0.61) NOD1PLA2G2CKMT2APLA2G10POLB
SCHEMBL17446821 0.91 NOD1 (0.61) NOD1PLA2G2CKMT2APLA2G10POLB
SCHEMBL8015621 0.91 NOD1 (0.61) NOD1PLA2G2CKMT2APLA2G10POLB

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-2014056939-A1 LIPIDIC BIOMATERIALS FOR ENCAPSULATION AND TRIGGERED RELEASE Universität Zürich (CH) 2014-04-17 — — WO disclosed