SCHEMBL11268376

SCHEMBL11268376

O=C1CC(NC(=O)C(F)(F)F)C(=O)N1c1cc(Cl)cc(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.42
GAA P10253 5/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MAPT P10636 3/20 0.42
HSD17B10 Q99714 2/20 0.42
ALOX12 P18054 2/20 0.42
ALOX15 P16050 1/20 0.42
KDM4E B2RXH2 3/20 0.41
GFER P55789 1/20 0.41
LMNA P02545 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
USP2 O75604 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL11261682 0.83 ALDH1A1 (0.46) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL11270452 0.80 ALDH1A1 (0.46) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL11274308 0.80 ALDH1A1 (0.43) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL11270310 0.76 ALDH1A1 (0.42) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL11273510 0.75 ALDH1A1 (0.48) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL11400278 0.75 ALDH1A1 (0.41) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL11277740 0.75 GAA (0.57) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL11273512 0.75 ALDH1A1 (0.45) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL11264416 0.75 ALDH1A1 (0.41) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL11266756 0.74 ALDH1A1 (0.41) ALDH1A1GAAMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4332816-A PHYTOPATHOGENS CIBA-GEIGY CORPORATION (US) 1982-06-01 US claimed
EP-0031297-A2 2,5 dioxo pyrrolidin compounds, process for their preparation and their use as microbicides CIBA-GEIGY AG (CH) 1981-07-01 EP claimed
US-4332816-A PHYTOPATHOGENS CIBA-GEIGY CORPORATION (US) 1982-06-01 US disclosed
EP-0031297-A2 2,5 dioxo pyrrolidin compounds, process for their preparation and their use as microbicides CIBA-GEIGY AG (CH) 1981-07-01 EP disclosed