SCHEMBL18084239

SCHEMBL18084239

CC(=O)C(N)(CS)CCN

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 2/20 0.34
ODC1 P11926 1/20 0.32
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
THRB P10828 1/20 0.30
ALOX15 P16050 1/20 0.30
NFKB1 P19838 1/20 0.30
PTGS2 P35354 1/20 0.30
THPO P40225 1/20 0.30
RECQL P46063 1/20 0.30
BLM P54132 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL2854826 0.79 ODC1 (0.47) ODC1KDM4EMAPTTHRBBLM
SCHEMBL148366 0.67 ODC1 (0.54) ODC1KDM4EMAPTTHRBBLM
SCHEMBL18882997 0.65
SCHEMBL21663995 0.65
SCHEMBL16259499 0.65
SCHEMBL5324175 0.65 MEN1 (0.65) ODC1KDM4EMAPTTHRBBLM
SCHEMBL20636765 0.65 ODC1 (0.38) PAOXODC1KDM4EMAPTTHRB
SCHEMBL28792659 0.65 ODC1 (0.38) PAOXODC1KDM4EMAPTTHRB
SCHEMBL15315407 0.65 PAOX (0.44) PAOXODC1KDM4EMAPTTHRB
Ethylenediamine SCHEMBL20657069 0.64 PAOX (0.36) PAOXODC1ALOX15BLM

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-2648724-B1 HYDROXYLATED AMINOTRIAZOLE DERIVATIVES AS ALX RECEPTOR AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2016-09-21 EP disclosed