SCHEMBL4752789

SCHEMBL4752789

CN(C)C1CCCC(=O)C1=Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
HTT P42858 1/20 0.46
MAPT P10636 5/20 0.44
CYP1A2 P05177 4/20 0.44
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CYP2D6 P10635 2/20 0.44
CYP2C19 P33261 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HPGD P15428 4/20 0.40
F3 P13726 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
DUSP1 P28562 1/20 0.36
DUSP6 Q16828 1/20 0.36

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
SCHEMBL28228660 0.84 ALDH1A1 (0.43) ALDH1A1HTTMAPTCYP1A2LMNA
SCHEMBL3438388 0.80 ALDH1A1 (0.50) ALDH1A1HTTMAPTCYP1A2LMNA
SCHEMBL3438389 0.80 ALDH1A1 (0.50) ALDH1A1HTTMAPTCYP1A2LMNA
SCHEMBL3437903 0.77 ALDH1A1 (0.47) ALDH1A1HTTMAPTCYP1A2LMNA
SCHEMBL3437901 0.77 ALDH1A1 (0.47) ALDH1A1HTTMAPTCYP1A2LMNA
SCHEMBL28123686 0.76 ALDH1A1 (0.50) ALDH1A1HTTMAPTCYP1A2LMNA
SCHEMBL3438441 0.76 ALDH1A1 (0.46) ALDH1A1HTTMAPTCYP1A2LMNA
SCHEMBL3438440 0.76 ALDH1A1 (0.46) ALDH1A1HTTMAPTCYP1A2LMNA
SCHEMBL3438424 0.76 ALDH1A1 (0.46) ALDH1A1HTTMAPTCYP1A2LMNA
SCHEMBL3438425 0.76 ALDH1A1 (0.46) ALDH1A1HTTMAPTCYP1A2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107925147-A The manufacture method of antenna substrate, the manufacture method of antenna substrate and the manufacture method of RFID device with wiring and electrode 东丽株式会社 2018-04-17 CN disclosed
EP-1962789-A1 VOLUMIZING HAIR TREATMENT AGENT Henkel AG & Co. KGaA (DE) 2008-09-03 EP disclosed
WO-2007068308-A1 VOLUMIZING HAIR TREATMENT AGENT HENKEL AG & CO. KGAA (DE) 2007-06-21 WO disclosed