SCHEMBL1931676

SCHEMBL1931676

CN(C)Cc1ccc(C=CC(=O)c2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.62
CYP3A4 P08684 3/20 0.62
ALDH1A1 P00352 2/20 0.62
HPGD P15428 1/20 0.62
BCHE P06276 5/20 0.62
CYP1B1 Q16678 3/20 0.62
ACHE P22303 3/20 0.62
MAOB P27338 2/20 0.62
LMNA P02545 2/20 0.62
PLIN1 O60240 1/20 0.62
TNFRSF1A P19438 1/20 0.62
RECQL P46063 1/20 0.62
PLIN5 Q00G26 1/20 0.62
ABHD5 Q8WTS1 1/20 0.62
HDAC3 O15379 2/20 0.61
HDAC6 Q9UBN7 2/20 0.61
RAB9A P51151 4/20 0.59
KMT2A Q03164 4/20 0.59
NFKB1 P19838 2/20 0.59
NFKB2 Q00653 2/20 0.59

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
SCHEMBL5915335 0.83 F3 (0.73) MAPTCYP3A4ALDH1A1BCHECYP1B1
SCHEMBL5915334 0.83 F3 (0.73) MAPTCYP3A4ALDH1A1BCHECYP1B1
SCHEMBL5915802 0.83 F3 (0.73) MAPTCYP3A4ALDH1A1BCHECYP1B1
SCHEMBL655660 0.83 MAPT (0.68) MAPTCYP3A4ALDH1A1HPGDBCHE
SCHEMBL655661 0.83 MAPT (0.68) MAPTCYP3A4ALDH1A1HPGDBCHE
SCHEMBL4575024 0.82 HDAC6 (0.71) CYP3A4ALDH1A1HPGDMAOBLMNA
SCHEMBL4575021 0.82 HDAC6 (0.71) CYP3A4ALDH1A1HPGDMAOBLMNA
SCHEMBL8431772 0.82 CYP1B1 (0.91) MAPTCYP3A4ALDH1A1HPGDBCHE
SCHEMBL9915665 0.82 CYP1B1 (0.91) MAPTCYP3A4ALDH1A1HPGDBCHE
SCHEMBL5915675 0.81 HDAC6 (0.57) MAPTCYP3A4ALDH1A1HPGDBCHE

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
US-20110129932-A1 Lipoprotein Assay L3 TECHNOLOGY LIMITED (GB) 2011-06-02 US disclosed
EP-2041579-A2 LIPOPROTEIN ASSAY L3 Technology Limited (GB) 2009-04-01 EP disclosed
WO-2007144601-A2 LIPOPROTEIN ASSAY L3 TECHNOLOGY LIMITED (GB) 2007-12-21 WO disclosed