SCHEMBL7328817

SCHEMBL7328817

CCCC1C(=O)N(C(S)c2nnnn2-c2ccccc2)S(=O)(=O)N1CC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.38
LMNA P02545 4/20 0.33
MAPT P10636 4/20 0.33
NPSR1 Q6W5P4 3/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
TSHR P16473 1/20 0.33
ELANE P08246 6/20 0.33
HTT P42858 3/20 0.33
HPGD P15428 2/20 0.33
TP53 P04637 1/20 0.33
HSP90AA1 P07900 1/20 0.33
NLRP1 Q9C000 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
GAA P10253 1/20 0.32
CCR6 P51684 2/20 0.32
CACNA1B Q00975 2/20 0.32
APBA1 Q02410 2/20 0.32

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
SCHEMBL7329793 0.90 ALDH1A1 (0.38) ALDH1A1LMNAMAPTNPSR1KMT2A
SCHEMBL7330906 0.80 ALDH1A1 (0.38) ALDH1A1LMNAMAPTNPSR1KMT2A
SCHEMBL7337980 0.76 NPSR1 (0.36) ALDH1A1LMNAMAPTNPSR1KMT2A
SCHEMBL7328809 0.73 ELANE (0.53) ALDH1A1MAPTKMT2AMEN1ELANE
SCHEMBL7339821 0.72 ALDH1A1 (0.36) ALDH1A1LMNAMAPTNPSR1KMT2A
SCHEMBL7304482 0.68 ELANE (0.52) ALDH1A1NPSR1KMT2AMEN1TSHR
SCHEMBL7339586 0.67 KMT2A (0.44) ALDH1A1NPSR1KMT2AMEN1TSHR
SCHEMBL7329786 0.66 ELANE (0.54) ALDH1A1MAPTKMT2AMEN1ELANE
SCHEMBL8872235 0.65 ELANE (0.49) ALDH1A1NPSR1ELANE
SCHEMBL8870910 0.65 ELANE (0.40) ALDH1A1ELANE

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
US-5494925-A TREATING DEGENERATIVE DISORDERS; PROTEOLYTIC ENZYME INHIBITOR STERLING WINTHROP INC. (US) 1996-02-27 US disclosed