SCHEMBL11260122

SCHEMBL11260122

N=C1NC(=O)c2ccc(Cl)c(Cl)c21

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES1 P23141 5/20 0.47
PPOX P50336 1/20 0.38
SIRT2 Q8IXJ6 3/20 0.36
HTR2A P28223 2/20 0.34
HTR2C P28335 2/20 0.34
HTR2B P41595 2/20 0.34
PARP1 P09874 3/20 0.33
PKM P14618 2/20 0.33
MAPT P10636 1/20 0.33
SIRT1 Q96EB6 2/20 0.33
SIRT3 Q9NTG7 1/20 0.33
GSK3B P49841 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32

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
SCHEMBL22268122 0.83 CES1 (0.40) CES1PPOXHTR2AHTR2CHTR2B
SCHEMBL454553 0.82 PPOX (0.52) CES1PPOXSIRT2HTR2AHTR2C
SCHEMBL9148787 0.82 CES1 (0.38) CES1
SCHEMBL28641724 0.80 CES1 (0.50) CES1PPOXSIRT2HTR2AHTR2C
SCHEMBL11260054 0.77 CES1 (0.47) CES1PARP1GSK3B
SCHEMBL11222151 0.75 CES1 (0.47) CES1PPOX
SCHEMBL11222720 0.71 CES1 (0.41) CES1PPOX
SCHEMBL11226468 0.71 CES1 (0.41) CES1PPOX
SCHEMBL29011346 0.69 PPOX (0.52) CES1PPOXPARP1PKMGSK3B
SCHEMBL28721617 0.69 ATM (0.47) CES1PPOXPARP1PKMMAPT

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
US-4317929-A Tetraphenylketazines and isoindolinone pigments obtained therefrom CIBA-GEIGY CORPORATION (US) 1982-03-02 US disclosed
US-4231931-A YELLOW TO RED HUES CIBA-GEIGY CORPORATION (US) 1980-11-04 US disclosed