SCHEMBL6565344

SCHEMBL6565344

CCCCCCNC(=O)c1ccccc1C(N)=O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.73
HTT P42858 1/20 0.73
NAAA Q02083 3/20 0.70
HPGD P15428 2/20 0.62
ALOX15 P16050 3/20 0.55
LMNA P02545 2/20 0.55
ALDH1A1 P00352 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HCRTR1 O43613 1/20 0.54
MEN1 O00255 1/20 0.54
NR1I2 O75469 1/20 0.54
CHRM2 P08172 1/20 0.54
CYP3A4 P08684 1/20 0.54
ADRA2A P08913 1/20 0.54
MAPT P10636 1/20 0.54
OPRK1 P41145 1/20 0.54
HTR2B P41595 1/20 0.54
SLC6A3 Q01959 1/20 0.54
KMT2A Q03164 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54

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
SCHEMBL6567072 1.00 TSHR (0.73) TSHRHTTNAAAHPGDALOX15
SCHEMBL28428107 1.00 TSHR (0.73) TSHRHTTNAAAHPGDALOX15
SCHEMBL29748296 1.00 TSHR (0.73) TSHRHTTNAAAHPGDALOX15
SCHEMBL29862779 1.00 TSHR (0.73) TSHRHTTNAAAHPGDALOX15
SCHEMBL28427018 1.00 TSHR (0.73) TSHRHTTNAAAHPGDALOX15
SCHEMBL29863603 1.00 TSHR (0.73) TSHRHTTNAAAHPGDALOX15
SCHEMBL6565410 1.00 TSHR (0.73) TSHRHTTNAAAHPGDALOX15
SCHEMBL2048527 1.00 TSHR (0.73) TSHRHTTNAAAHPGDALOX15
SCHEMBL4443780 1.00 TSHR (0.73) TSHRHTTNAAAHPGDALOX15
SCHEMBL5223903 0.98 TSHR (0.75) TSHRHTTNAAAHPGDALOX15

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
EP-0854177-B1 Ink compositions XEROX CORP (US) 2004-03-31 EP claimed
EP-0854177-B1 Ink compositions XEROX CORP (US) 2004-03-31 EP disclosed