SCHEMBL17377307

SCHEMBL17377307

CC[C@H](Cl)C(=O)N(c1ccccc1C)C(C)COC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
THRB P10828 1/20 0.40
ALDH1A1 P00352 6/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TP53 P04637 2/20 0.38
MAPT P10636 1/20 0.38
GAA P10253 1/20 0.37
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP3A4 P08684 2/20 0.35
LMNA P02545 2/20 0.35
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL6642557 1.00 KDM4E (0.42) KDM4ETHRBALDH1A1MEN1KMT2A
SCHEMBL10371941 0.88 THRB (0.42) KDM4ETHRBALDH1A1MEN1KMT2A
SCHEMBL11500146 0.83 KDM4E (0.37) KDM4EALDH1A1MEN1KMT2ATP53
SCHEMBL10958809 0.83 ALDH1A1 (0.43) KDM4ETHRBALDH1A1MEN1KMT2A
SCHEMBL11440952 0.82 MEN1 (0.33) KDM4ETHRBALDH1A1MEN1KMT2A
SCHEMBL9212083 0.80 THRB (0.57) KDM4ETHRBALDH1A1MEN1KMT2A
SCHEMBL11340866 0.80 KDM4E (0.40) KDM4ETHRBALDH1A1MEN1KMT2A
Ethane SCHEMBL4336672 0.79 THRB (0.56) KDM4ETHRBALDH1A1MEN1KMT2A
SCHEMBL11451628 0.78 POLQ (0.40) KDM4ETHRBALDH1A1MEN1KMT2A
SCHEMBL11216913 0.77 TP53 (0.43) KDM4EALDH1A1MEN1KMT2ATP53

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-3160230-A2 FORMULATION OF CLOMAZONE HAVING REDUCED VOLATILITY BASF SE (DE) 2017-05-03 EP disclosed
WO-2015197487-A2 FORMULATION OF CLOMAZONE HAVING REDUCED VOLATILITY BASF SE (DE) 2015-12-30 WO disclosed