SCHEMBL3703471

SCHEMBL3703471

O=S(=O)(c1cccc2ccccc12)N(c1ccccc1)c1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
KEAP1 Q14145 1/20 0.51
NFE2L2 Q16236 1/20 0.51
PKM P14618 1/20 0.47
PRSS1 P07477 3/20 0.47
C1R P00736 1/20 0.47
HTR2A P28223 2/20 0.47
HTR2C P28335 2/20 0.47
TSHR P16473 2/20 0.45
PGR P06401 1/20 0.45
F2 P00734 2/20 0.45
PRSS2 P07478 2/20 0.45
PRSS3 P35030 2/20 0.45
HTR6 P50406 2/20 0.45
ESR1 P03372 1/20 0.44
HTR1A P08908 1/20 0.44
HTR7 P34969 1/20 0.44
DRD3 P35462 1/20 0.44

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
SCHEMBL3698727 0.86 CA9 (0.47) CA1CA2CA9KEAP1NFE2L2
SCHEMBL3698233 0.84 CA1 (0.45) CA1CA2CA9KEAP1NFE2L2
SCHEMBL28627258 0.78 CA1 (0.46) CA1CA2CA9KEAP1NFE2L2
SCHEMBL3248145 0.77 CA1 (0.57) CA1CA2CA9KEAP1NFE2L2
SCHEMBL18537467 0.77 CA1 (0.57) CA1CA2CA9KEAP1NFE2L2
SCHEMBL22182916 0.77 CA1 (0.57) CA1CA2CA9KEAP1NFE2L2
SCHEMBL4506268 0.76 CA1 (0.44) CA1CA2CA9PKMHTR6
Hydrochloric Acid SCHEMBL28348315 0.76 HTR2A (0.55) CA1CA2CA9KEAP1NFE2L2
SCHEMBL11000088 0.76 CA1 (0.55) CA1CA2CA9KEAP1NFE2L2
SCHEMBL5316640 0.75 KEAP1 (0.49) CA1CA2CA9KEAP1NFE2L2

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-20120118616-A1 NEGATIVE PHOTOSENSITIVE RESIN COMPOSITION, POLYIMIDE RESIN FILM USING SAME, AND FLEXIBLE PRINTED CIRCUIT BOARD SUMITOMO ELECTRIC PRINTED CIRCUITS, INC. (JP) 2012-05-17 US disclosed