SCHEMBL11290459

SCHEMBL11290459

CC(=O)SCC(=O)N(CC(=O)O)c1c(C)ccc(Cl)c1C

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
ALOX15 P16050 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 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
SCHEMBL11290058 0.89 HDAC3 (0.31)
SCHEMBL11349473 0.89 SMN1; SMN2 (0.34) SMN1; SMN2ALDH1A1MAPTMEN1ALOX15
SCHEMBL11289099 0.88 SMN1; SMN2 (0.33) SMN1; SMN2ALDH1A1MAPTMEN1ALOX15
SCHEMBL11299749 0.88 SMN1; SMN2 (0.34) SMN1; SMN2ALDH1A1MAPTMEN1ALOX15
SCHEMBL11277898 0.86 RAB9A (0.41) ALDH1A1MAPTMEN1ALOX15MAPK1
SCHEMBL11297292 0.86 SMN1; SMN2 (0.33) SMN1; SMN2ALDH1A1MAPTMEN1ALOX15
SCHEMBL11414665 0.85 SMN1; SMN2 (0.33) SMN1; SMN2ALDH1A1MAPTMEN1ALOX15
SCHEMBL11314993 0.85 SMN1; SMN2 (0.33) SMN1; SMN2ALDH1A1MAPTMEN1ALOX15
SCHEMBL11494654 0.85 KMT2A (0.46) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL11297070 0.85

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0014167-B1 Aniline derivatives with antifungal activity and process for their preparation RHONE-POULENC AGROCHIMIE (FR) 1982-06-30 EP disclosed
EP-0014167-A1 Aniline derivatives with antifungal activity and process for their preparation RHONE-POULENC AGROCHIMIE (FR) 1980-08-06 EP disclosed