SCHEMBL15955641

SCHEMBL15955641

NNc1c(Cl)cc(Sc2c(Cl)cccc2Cl)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
PTGIR P43119 1/20 0.36
GAA P10253 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
SOD1 P00441 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
SCHEMBL15955601 0.79 CHRNA7 (0.39) ALDH1A1LMNAHPGDTDP1
SCHEMBL15955878 0.79 ALDH1A1 (0.41) ALDH1A1PTGIRSOD1
SCHEMBL1144086 0.75 GAA (0.44) ALDH1A1GAAMEN1LMNAMAPT
SCHEMBL15955533 0.73 ALDH1A1 (0.37) ALDH1A1PTGIRGAAMEN1LMNA
SCHEMBL15955763 0.73 PGR (0.38) MEN1MAPTHPGDKMT2A
Bromide SCHEMBL20984793 0.73 GAA (0.42) ALDH1A1GAAMEN1LMNAMAPT
Hydrochloric Acid SCHEMBL839849 0.73 GAA (0.42) ALDH1A1GAAMEN1LMNAMAPT
SCHEMBL15955490 0.72 RAPGEF4 (0.39) ALDH1A1MAPT
Hydrochloric Acid SCHEMBL21357474 0.71 GAA (0.41) ALDH1A1GAAMEN1LMNAMAPT
SCHEMBL28715207 0.70 CYP1A2 (0.47) ALDH1A1PTGIRMEN1LMNAMAPT

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
WO-2014126580-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2014-08-21 WO disclosed
WO-2014126580-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2014-08-21 WO disclosed