SCHEMBL9214178

SCHEMBL9214178

CC(Cl)C(=O)C(C#N)c1ccc(Cl)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.45
TP53 P04637 1/20 0.45
HTT P42858 1/20 0.45
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
POLB P06746 2/20 0.40
MAPT P10636 2/20 0.38
GABRA1 P14867 4/20 0.38
GABRG2 P18507 4/20 0.38
GABRB3 P28472 4/20 0.38
GABRB2 P47870 3/20 0.38
EEF2K O00418 1/20 0.37
GABRB1 P18505 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
SCHEMBL6049469 0.83 ALDH1A1 (0.47) LMNATP53HTTMEN1KMT2A
SCHEMBL11029644 0.79 LMNA (0.42) LMNATP53HTTMEN1KMT2A
SCHEMBL9213048 0.78 GAA (0.43) LMNATP53HTTMEN1KMT2A
SCHEMBL8749242 0.78 GAA (0.43) LMNATP53HTTMEN1KMT2A
SCHEMBL5729690 0.76 MAPT (0.41) LMNATP53HTTMEN1KMT2A
SCHEMBL11566434 0.76 LMNA (0.52) LMNATP53HTTMEN1KMT2A
SCHEMBL9214383 0.75 PPARG (0.40) LMNATP53MEN1KMT2AALDH1A1
SCHEMBL27671813 0.73 LMNA (0.57) LMNATP53HTTMEN1KMT2A
SCHEMBL28126666 0.71 TP53 (0.48) LMNATP53HTTMEN1KMT2A
Diclocymet SCHEMBL674274 0.70 MEN1 (0.50) LMNAMEN1KMT2APOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0506373-B1 Cyanoketone derivative and herbicide containing it as an active component TOKUYAMA CORP (JP) 1995-11-29 EP disclosed
US-5234894-A CARBONYL ACETONITRILE DERIVATIVE AND HERBICIDE CONTAINING IT AS AN ACTIVE COMPONENT TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1993-08-10 US disclosed
EP-0506373-A2 Cyanoketone derivative and herbicide containing it as an active component TOKUYAMA CORPORATION (JP) 1992-09-30 EP disclosed