SCHEMBL15420246

SCHEMBL15420246

CCN(CC)C(=O)c1cc(F)c(F)c(F)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.51
RECQL P46063 1/20 0.51
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
HPGD P15428 6/20 0.49
MLYCD O95822 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
HSP90AA1 P07900 5/20 0.47
HSP90AB1 P08238 5/20 0.47
ALDH1A1 P00352 3/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CYP1A2 P05177 1/20 0.44
BLM P54132 1/20 0.44
NPC1 O15118 1/20 0.43
PKM P14618 1/20 0.43
CDK5 Q00535 1/20 0.43

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
SCHEMBL29175215 0.82 MLYCD (0.55) LMNARECQLCES2CES1HPGD
SCHEMBL1097992 0.81 HSP90AA1 (0.57) LMNACES2CES1HPGDMLYCD
SCHEMBL31217538 0.80 CA1 (0.47) LMNARECQLHPGDMLYCDTDP1
SCHEMBL471664 0.78 HPGD (0.66) LMNAHPGDMLYCDTDP1HSP90AA1
SCHEMBL30786345 0.78 HPGD (0.66) LMNAHPGDMLYCDTDP1HSP90AA1
SCHEMBL8572282 0.77 CES2 (0.56) CES2CES1HPGDALDH1A1SMN1; SMN2
SCHEMBL10266907 0.77 HPGD (0.64) LMNARECQLHPGDMLYCDTDP1
SCHEMBL29175209 0.76 HPGD (0.57) LMNARECQLHPGDMLYCDTDP1
SCHEMBL3741746 0.75 HPGD (0.67) LMNARECQLHPGDMLYCDTDP1
SCHEMBL6001785 0.75 LMNA (0.59) LMNARECQLHPGDMLYCDTDP1

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 5 patents. 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
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 disclosed
US-9605207-B2 Orthoester derivative, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2017-03-28 US disclosed
EP-2690103-A1 ORTHO ESTER DERIVATIVE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2014-01-29 EP disclosed
US-20140021407-A1 ORTHOESTER DERIVATIVE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-01-23 US disclosed