SCHEMBL13061952

SCHEMBL13061952

C/C=C1\C=CN(C)c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
ALDH1A1 P00352 4/20 0.49
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
HTT P42858 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
KDM4E B2RXH2 3/20 0.49
NPSR1 Q6W5P4 3/20 0.49
POLB P06746 1/20 0.49
BLM P54132 1/20 0.49
MCL1 Q07820 1/20 0.49
MAPK1 P28482 3/20 0.35
THRB P10828 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
TTR P02766 1/20 0.33
CES1 P23141 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL10625407 0.80 MAPT (0.46) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL10625415 0.80 MAPT (0.46) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL20694546 0.77 ALDH1A1 (0.51) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL11208303 0.76 MEN1 (0.43) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL11208299 0.76 MEN1 (0.43) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL10105233 0.72 NPC1 (0.38) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL12240567 0.72 MEN1 (0.40) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL14065135 0.71 ALDH1A1 (0.39) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL278447 0.69 KDM4E (0.57) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL16403819 0.69 ALDH1A1 (0.38) MAPTMEN1KMT2AALDH1A1NPC1

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
WO-2021145456-A1 INFRARED BLOCKING FILTER, FILTER FOR SOLID-STATE IMAGING ELEMENT, SOLID-STATE IMAGING ELEMENT, AND METHOD FOR PRODUCING FILTER FOR SOLID-STATE IMAGING ELEMENT 凸版印刷株式会社 2021-07-22 WO disclosed
US-7855293-B2 Fluorescent dyes such as 2-(4-acetanilino-1,3-butadieneyl)-3-spiro-1'-cyclohexan-1-(4-sulfobutyl)-3H -indolium hydroxide metal salts which couple biological materials without loss of fluorescence due to self-quenching HAALCK LUTZ 2010-12-21 US disclosed