SCHEMBL8036860

SCHEMBL8036860

CC1=Cc2c(cccc2S(=O)(=O)Cl)C(=O)C1=[N+]=[N-]

nearest known ligand 0.30

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
PLIN1 O60240 1/20 0.30
NR1I2 O75469 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GSR P00390 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
GAA P10253 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPT P10636 1/20 0.30
HSPD1 P10809 1/20 0.30
CYP2C9 P11712 1/20 0.30
PKM P14618 1/20 0.30
IDO1 P14902 1/20 0.30
UCHL3 P15374 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL13155736 0.74 PTPRC (0.31) IDO1MAOAMAOBCDC25BSNCA
SCHEMBL823909 0.72
SCHEMBL8976633 0.71
Charcoal, Activated SCHEMBL8036863 0.71
SCHEMBL2400017 0.65 PTPRC (0.45) MEN1USP2ALDH1A1LMNATP53
SCHEMBL13155734 0.65 PTPN1 (0.41) MEN1PLIN1NR1I2USP2ALDH1A1
SCHEMBL7077258 0.65
SCHEMBL10590653 0.64
SCHEMBL23940757 0.64 S100A4 (0.36) MEN1PLIN1NR1I2USP2ALDH1A1
SCHEMBL9644392 0.64 CDC25B (0.37) MEN1ALDH1A1LMNAMAPTPKM

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
US-6117610-A A MIXTURE OR A REACTION PRODUCT OF A PHENOLIC RESIN AND AN O-DIAZONAPHTHOQUINONE, A NON-BASIC INFRARED ABSORBER AND A DISSOLUTION INHIBITOR INSENSITIVE TO ACTINIC RADIATION; POSITIVE AND NEGATIVE LITHOGRAPHIC PRINTING PLATES KODAK POLYCHROME GRAPHICS LLC (US) 2000-09-12 US disclosed