SCHEMBL471664

SCHEMBL471664

CCN(CC)C(=O)c1ccc(C)c(F)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.66
TDP1 Q9NUW8 1/20 0.56
LMNA P02545 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
HSP90AA1 P07900 5/20 0.54
HSP90AB1 P08238 5/20 0.54
HDAC1 Q13547 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
MLYCD O95822 1/20 0.51
ALDH1A1 P00352 4/20 0.50
CYP1A2 P05177 1/20 0.50
BLM P54132 1/20 0.50
MAPT P10636 1/20 0.49
RAB9A P51151 2/20 0.48
OPRD1 P41143 2/20 0.47
NPC1 O15118 1/20 0.46
PKM P14618 1/20 0.46
CDK5 Q00535 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
SCHEMBL30786345 1.00 HPGD (0.66) HPGDTDP1LMNAMEN1KMT2A
SCHEMBL1097992 0.86 HSP90AA1 (0.57) HPGDTDP1LMNAMEN1KMT2A
SCHEMBL471665 0.84 HPGD (0.72) HPGDTDP1LMNAMEN1KMT2A
SCHEMBL12184181 0.83 HPGD (0.48) HPGDTDP1LMNAMEN1KMT2A
SCHEMBL10266907 0.81 HPGD (0.64) HPGDTDP1LMNAMEN1KMT2A
SCHEMBL18661938 0.81 HPGD (0.68) HPGDTDP1LMNAMEN1KMT2A
SCHEMBL16905393 0.80 HDAC1 (0.58) HPGDLMNAKMT2ASMN1; SMN2HDAC1
SCHEMBL10156527 0.79 HPGD (0.66) HPGDTDP1LMNAMEN1KMT2A
SCHEMBL9686186 0.79 HSP90AA1 (0.71) HPGDTDP1LMNAMEN1KMT2A
SCHEMBL24476677 0.79 HSP90AA1 (0.66) HPGDTDP1LMNAMEN1KMT2A

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
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