SCHEMBL22509292

SCHEMBL22509292

C/N=C(\NC)NCCC[C@H](NC)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.51
▸ FOLH1 Q04609 6/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ CACNA1B Q00975 2/20 0.34
▸ NOD1 Q9Y239 2/20 0.32
▸ SCN5A Q14524 1/20 0.31
▸ SCN2A Q99250 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ C3AR1 Q16581 1/20 0.30

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
SCHEMBL21196892 1.00 KDM1A (0.51) KDM1AFOLH1MEN1GAAKMT2A
SCHEMBL15316693 0.87 KDM1A (0.51) KDM1AFOLH1CACNA1B
SCHEMBL22236486 0.82 KDM1A (0.53) KDM1AMEN1GAAKMT2ASCN5A
SCHEMBL13485480 0.81 KDM1A (0.51) KDM1AMEN1KMT2A
SCHEMBL14842600 0.81 KDM1A (0.51) KDM1AMEN1KMT2A
SCHEMBL18071127 0.81 KDM1A (0.51) KDM1AMEN1KMT2A
SCHEMBL4407451 0.81 KDM1A (0.51) KDM1AMEN1KMT2A
SCHEMBL21195165 0.81 KDM1A (0.51) KDM1AMEN1KMT2A
SCHEMBL287988 0.81 KDM1A (0.51) KDM1AMEN1KMT2A
SCHEMBL22644359 0.81 DDAH1 (0.40) FOLH1MEN1GAAKMT2ACACNA1B

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-2020204994-A1 ANTIBODIES TO SYMMETRICALLY DIMETHYLATED ARGININE ANALYTES AND USE THEREOF ARK DIAGNOSTICS, INC. (US) 2020-10-08 — — WO disclosed
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