SCHEMBL15080557

SCHEMBL15080557

CN1C(=O)C(=CNc2ccccc2)C(=O)N(C)C1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.53
MAPT P10636 7/20 0.46
RXFP1 Q9HBX9 1/20 0.46
XDH P47989 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
POLB P06746 1/20 0.41
KDM4E B2RXH2 2/20 0.41
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
HSP90AA1 P07900 1/20 0.40
HSP90AB1 P08238 1/20 0.40
EP300 Q09472 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
APP P05067 1/20 0.39

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
SCHEMBL14734850 0.83 MAPT (0.45) ALDH1A1MAPTRXFP1XDHSMN1; SMN2
SCHEMBL8446009 0.83 MAPT (0.45) ALDH1A1MAPTXDHSMN1; SMN2LMNA
SCHEMBL3563637 0.81 APP (0.50) ALDH1A1MAPTSMN1; SMN2LMNAGAA
SCHEMBL3563633 0.81 APP (0.50) ALDH1A1MAPTSMN1; SMN2LMNAGAA
SCHEMBL19240095 0.80 APP (0.43) ALDH1A1MAPTRXFP1XDHSMN1; SMN2
SCHEMBL10589671 0.78 HSP90AA1 (0.48) ALDH1A1MAPTRXFP1SMN1; SMN2LMNA
SCHEMBL8121820 0.77 NPC1 (0.45) ALDH1A1MAPTSMN1; SMN2LMNATSHR
SCHEMBL8362622 0.77 KMT2A (0.46) ALDH1A1MAPTLMNAGAATSHR
SCHEMBL16465058 0.74 ALDH1A1 (0.60) ALDH1A1MAPTSMN1; SMN2LMNAGAA
SCHEMBL3564987 0.74 APP (0.46) ALDH1A1MAPTSMN1; SMN2LMNAGAA

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
US-8476433-B2 Agent exhibiting the properties of a cognitive function promoter (embodiments) UNIKORM (RU) 2013-07-02 US disclosed