SCHEMBL11060422

SCHEMBL11060422

Cc1cc2[nH]c3ccc(S(=O)(=O)N(C)C)cc3c(=O)n2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.44
PARP1 P09874 2/20 0.41
CYP1A2 P05177 1/20 0.40
ALDH1A1 P00352 6/20 0.38
KDM4E B2RXH2 4/20 0.38
MAPT P10636 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HPGD P15428 3/20 0.37
LMNA P02545 2/20 0.37
PLA2G1B P04054 1/20 0.37
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37

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
SCHEMBL11060925 0.85 PARP1 (0.42) PARP1CYP1A2ALDH1A1KDM4EMAPT
SCHEMBL11148472 0.78 PKM (0.60) PARP1CYP1A2ALDH1A1KDM4EMAPT
SCHEMBL11061300 0.78 CA12 (0.50) PARP1CYP1A2ALDH1A1KDM4EMAPT
SCHEMBL11155681 0.75 PTGS2 (0.40) PARP1CYP1A2KDM4EMAPTRAB9A
SCHEMBL9217948 0.74 ALDH1A1 (0.62) PARP1CYP1A2ALDH1A1KDM4EMAPT
SCHEMBL11626732 0.71 FEN1 (0.49) PARP1CYP1A2ALDH1A1KDM4EMAPT
SCHEMBL11159015 0.70 KDM4E (0.39) ALDH1A1KDM4EMAPTNPC1RAB9A
SCHEMBL8414074 0.68 KDM4E (0.64) PARP1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL6763632 0.68 POLB (0.61) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL11344371 0.67 POLB (0.50) HTR6ALDH1A1KDM4EMAPTMEN1

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-4461827-A Color photographic recording material containing a non-diffusible dye releaser from which a complexible azo dye is released during development AGFA-GEVAERT AKTIENGESELLSCHAFT (DE) 1984-07-24 US disclosed