SCHEMBL30786343

SCHEMBL30786343

CCN(CCF)C(=O)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.64
ALDH1A1 P00352 3/20 0.64
MAPT P10636 1/20 0.59
GAA P10253 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.53
HDAC1 Q13547 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
OPRD1 P41143 3/20 0.49
OPRM1 P35372 1/20 0.49
OPRK1 P41145 1/20 0.49
MLYCD O95822 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
LMNA P02545 1/20 0.47

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
SCHEMBL11212992 0.89 HPGD (0.72) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL1003832 0.86 HPGD (0.64) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL2614245 0.85 HPGD (0.71) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL5166929 0.85 HPGD (0.68) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL72112 0.85 HPGD (0.85) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL1003828 0.84 HPGD (0.66) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL11213668 0.84 HPGD (0.69) HPGDALDH1A1MAPTGAAL3MBTL1
Hydrochloric Acid SCHEMBL6612619 0.83 HPGD (0.81) HPGDALDH1A1MAPTGAAL3MBTL1
Hydrochloric Acid SCHEMBL8527466 0.83 HPGD (0.81) HPGDALDH1A1MAPTGAAL3MBTL1
Fluoride SCHEMBL28693456 0.83 HPGD (0.81) HPGDALDH1A1MAPTGAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117486753-A Fluorine-containing benzoyl diethylamine compound with mosquito repellent effect, method and application thereof in mosquito repellent 天津科技大学 2024-02-02 CN claimed