SCHEMBL7746646

SCHEMBL7746646

COc1ccccc1N(Cc1ccccc1)C([NH])=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
ALDH1A1 P00352 2/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
ACHE P22303 3/20 0.46
BCHE P06276 2/20 0.46
TRPM8 Q7Z2W7 1/20 0.46
HSD17B1 P14061 1/20 0.45
HSD17B2 P37059 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
TP53 P04637 2/20 0.43
GLA P06280 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL7746650 0.85 SMN1; SMN2 (0.49) SMN1; SMN2KMT2AMEN1ALDH1A1ALOX15
SCHEMBL1334670 0.81 POLB (0.50) SMN1; SMN2KMT2AMEN1ALDH1A1ALOX15
SCHEMBL10941845 0.78 ESR1 (0.49) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR
SCHEMBL6778747 0.76 NPC1 (0.55) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR
SCHEMBL3043454 0.75 ALDH1A1 (0.47) SMN1; SMN2KMT2AMEN1ALDH1A1ALOX15
SCHEMBL12368118 0.75 TSHR (0.50) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR
SCHEMBL11472981 0.75 LPAR1 (0.44) SMN1; SMN2ALDH1A1HTTTRPM8KDM4E
SCHEMBL5656279 0.74 L3MBTL1 (0.47) SMN1; SMN2KMT2AMEN1ALDH1A1HTT
SCHEMBL5655779 0.74 SMN1; SMN2 (0.42) SMN1; SMN2KMT2AMEN1ALDH1A1ALOX15
SCHEMBL11136125 0.74 KDM4E (0.50) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR

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-2001010798-A1 SOLID PHASE SYNTHESIS OF OXA- AND THIAZOLES CHEMRX ADVANCED TECHNOLOGIES, INC. (US) 2001-02-15 WO disclosed