SCHEMBL14763777

SCHEMBL14763777

O=C1C=C(P)C(=O)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
MAPK1 P28482 5/20 0.56
CDC25B P30305 4/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
LMNA P02545 4/20 0.56
ALDH1A1 P00352 4/20 0.56
IDO1 P14902 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
MAOA P21397 3/20 0.56
HPGD P15428 3/20 0.56
CDC25A P30304 2/20 0.56
PLIN1 O60240 2/20 0.56
BLM P54132 2/20 0.56
PLIN5 Q00G26 2/20 0.56
ABHD5 Q8WTS1 2/20 0.56
MAOB P27338 2/20 0.56
SNCA P37840 2/20 0.56
CYP3A4 P08684 2/20 0.56
GAA P10253 2/20 0.56

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
Bromide SCHEMBL14764196 0.98 MAPT (0.54) MAPTMAPK1CDC25BMEN1KMT2A
SCHEMBL14764077 0.88 MAPT (0.50) MAPTMAPK1CDC25BMEN1KMT2A
SCHEMBL6555840 0.75 BACE1 (0.75) MAPTMAPK1CDC25BMEN1KMT2A
SCHEMBL4657279 0.73 MAPT (0.58) MAPTMAPK1CDC25BMEN1KMT2A
SCHEMBL25358615 0.71 MAPT (0.56) MAPTMAPK1CDC25BMEN1KMT2A
SCHEMBL125298 0.71 CDC25B (0.56) MAPTMAPK1CDC25BMEN1KMT2A
SCHEMBL13769114 0.71 CDC25B (0.56) MAPTMAPK1CDC25BMEN1KMT2A
Menadione SCHEMBL1364028 0.71 MAPT (1.00) MAPTMAPK1CDC25BMEN1KMT2A
Lawsone SCHEMBL6849999 0.71 MAPT (0.68) MAPTMAPK1CDC25BMEN1KMT2A
Menadione SCHEMBL19356853 0.71 MAPT (1.00) MAPTMAPK1CDC25BMEN1KMT2A

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
WO-2013036766-A1 SMALL MOLECULE NAPHTHOQUINONE- AND PHTHALIMIDE-BASED LIPOCATIONS AS ANTI-PARASITIC AGENTS UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2013-03-14 WO disclosed