SCHEMBL11402011

SCHEMBL11402011

CC(C)(NC(=O)Cc1cccc(Cl)c1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
ALDH1A1 P00352 2/20 0.53
HPGD P15428 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
SHMT1 P34896 3/20 0.53
SHMT2 P34897 1/20 0.53
KCNQ2 O43526 3/20 0.51
ANO1 Q5XXA6 1/20 0.49
SIGMAR1 Q99720 1/20 0.49
EPHX2 P34913 1/20 0.49
CACNA1G O43497 1/20 0.48
CACNA1H O95180 1/20 0.48
CACNA1C Q13936 1/20 0.48
CACNA1I Q9P0X4 1/20 0.48
CTBP2 P56545 1/20 0.48
FFAR2 O15552 1/20 0.46
CSNK1D P48730 2/20 0.46
P2RX7 Q99572 1/20 0.46
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL11374247 0.86 ANO1 (0.49) MEN1KMT2AALDH1A1SMN1; SMN2SHMT1
SCHEMBL9360320 0.85 P2RX7 (0.55) MEN1KMT2AALDH1A1HPGDSMN1; SMN2
SCHEMBL11066054 0.84 KCNQ2 (0.49) MEN1KMT2AALDH1A1HPGDSMN1; SMN2
SCHEMBL11035296 0.78 KCNJ5 (0.58) MEN1KMT2AALDH1A1ANO1
SCHEMBL3677265 0.77 USP36 (0.49) MEN1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL11038352 0.76 TRPV1 (0.47) MEN1KMT2AALDH1A1SMN1; SMN2ANO1
SCHEMBL21980983 0.76 KMT2A (0.61) MEN1KMT2AALDH1A1HPGDSMN1; SMN2
SCHEMBL6386462 0.76 MEN1 (0.59) MEN1KMT2AALDH1A1HPGDSMN1; SMN2
SCHEMBL924347 0.76 MEN1 (0.59) MEN1KMT2AALDH1A1HPGDSMN1; SMN2
SCHEMBL8858592 0.76 MEN1 (0.59) MEN1KMT2AALDH1A1HPGDSMN1; SMN2

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
JP-55149239-A None JP disclosed
JP-S55149239-A N-(ALPHA,ALPHA-DIMETHYLBENZYL)PHENYLACETAMIDE DERIVATIVE, ITS PREPARATION, AND HERBICIDE CONTAINING IT AS EFFECTIVE COMPONENT SUMITOMO CHEM CO LTD 1980-11-20 JP disclosed