SCHEMBL5223903

SCHEMBL5223903

CCCCCNC(=O)c1ccccc1C(N)=O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.75
HTT P42858 1/20 0.75
NAAA Q02083 3/20 0.68
HPGD P15428 2/20 0.64
HCRTR1 O43613 1/20 0.55
ALOX15 P16050 3/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
ALOX5 P09917 1/20 0.53
LMNA P02545 2/20 0.52
ALDH1A1 P00352 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MEN1 O00255 1/20 0.51
NR1I2 O75469 1/20 0.51
CHRM2 P08172 1/20 0.51
CYP3A4 P08684 1/20 0.51
ADRA2A P08913 1/20 0.51
MAPT P10636 1/20 0.51
OPRK1 P41145 1/20 0.51
HTR2B P41595 1/20 0.51
SLC6A3 Q01959 1/20 0.51

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
SCHEMBL28428107 0.98 TSHR (0.73) TSHRHTTNAAAHPGDHCRTR1
SCHEMBL4443780 0.98 TSHR (0.73) TSHRHTTNAAAHPGDHCRTR1
SCHEMBL29862779 0.98 TSHR (0.73) TSHRHTTNAAAHPGDHCRTR1
SCHEMBL29748296 0.98 TSHR (0.73) TSHRHTTNAAAHPGDHCRTR1
SCHEMBL6565344 0.98 TSHR (0.73) TSHRHTTNAAAHPGDHCRTR1
SCHEMBL2048527 0.98 TSHR (0.73) TSHRHTTNAAAHPGDHCRTR1
SCHEMBL6565410 0.98 TSHR (0.73) TSHRHTTNAAAHPGDHCRTR1
SCHEMBL29863603 0.98 TSHR (0.73) TSHRHTTNAAAHPGDHCRTR1
SCHEMBL28427018 0.98 TSHR (0.73) TSHRHTTNAAAHPGDHCRTR1
SCHEMBL6567072 0.98 TSHR (0.73) TSHRHTTNAAAHPGDHCRTR1

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 5 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-0591861-B1 Reactivity control in microcrystalline coupler dispersions EASTMAN KODAK CO (US) 1999-07-28 EP claimed
EP-1814874-A1 N-HETEROCYCLYL PHTHALIC ACID DIAMIDES AS INSECTICIDES Bayer CropScience AG (DE) 2007-08-08 EP disclosed
WO-2006053643-A1 N-HETEROCYCLYL PHTHALIC ACID DIAMIDES AS INSECTICIDES BAYER CROPSCIENCE AG (DE) 2006-05-26 WO disclosed
EP-0583832-A1 Color photographic materials containing 5-pyrazolone polymeric couplers and solvents EASTMAN KODAK COMPANY (US) 1994-02-23 EP disclosed