SCHEMBL9775860

SCHEMBL9775860

O=[N+]([O-])c1cccc([S])c1[N+](=O)[O-]

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.59
GPR35 Q9HC97 2/20 0.59
TDP1 Q9NUW8 5/20 0.52
ALDH1A1 P00352 6/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
S100A4 P26447 2/20 0.44
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PDE10A Q9Y233 1/20 0.40
PTPRC P08575 1/20 0.40
ERN1 O75460 1/20 0.40

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
Fluoride SCHEMBL946835 0.98 TSHR (0.57) TSHRGPR35TDP1ALDH1A1SMN1; SMN2
SCHEMBL118464 0.84 TSHR (0.71) TSHRGPR35TDP1ALDH1A1SMN1; SMN2
SCHEMBL1926046 0.84 TSHR (0.71) TSHRGPR35TDP1ALDH1A1SMN1; SMN2
SCHEMBL29669769 0.81 TSHR (0.68) TSHRGPR35TDP1ALDH1A1SMN1; SMN2
SCHEMBL7157905 0.81 TSHR (0.68) TSHRGPR35TDP1ALDH1A1SMN1; SMN2
Ammonia Solution, Strong SCHEMBL27735242 0.81 TSHR (0.68) TSHRGPR35TDP1ALDH1A1SMN1; SMN2
SCHEMBL28529002 0.81 TSHR (0.68) TSHRGPR35TDP1ALDH1A1SMN1; SMN2
SCHEMBL7157907 0.81 TSHR (0.68) TSHRGPR35TDP1ALDH1A1SMN1; SMN2
Fluoride SCHEMBL29099623 0.81 TSHR (0.68) TSHRGPR35TDP1ALDH1A1SMN1; SMN2
Hydrogen Sulfide SCHEMBL28144547 0.81 TSHR (0.68) TSHRGPR35TDP1ALDH1A1SMN1; SMN2

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4841030-A Azo reactive dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1989-06-20 US claimed
JP-55045721-A None JP disclosed
US-5066783-A Antiviral peptides and means for treating herpes infections COHEN ERIC A (CA) 1991-11-19 US disclosed
US-RE32992-E THERAPY FOR INFECTIOUS DISEASES CAUSED BY PATHOGENIC MICROORGANISMS Fujisawa Pharaceutical Co., Ltd. (JP) 1989-07-18 US disclosed
US-4801580-A Peptide, process for preparation thereof and use thereof FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1989-01-31 US disclosed
US-4795740-A Antiviral peptides and means for treating herpes infections COHEN ERIC A (CA) 1989-01-03 US disclosed
US-4749691-A Peptide, process for preparation thereof and use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-06-07 US disclosed
US-4725582-A IMMUNE RESPONSE ENHANCERS FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1988-02-16 US disclosed
EP-0246630-A2 Antiviral peptides and means for treating herpes infections Cohen, Eric A. (CA) 1987-11-25 EP disclosed
EP-0025842-B1 PEPTIDES, PROCESS FOR THEIR PREPARATION, THEIR PHARMACEUTICAL COMPOSITIONS AND THEIR INTERMEDIATES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-06-03 EP disclosed
US-4458078-A SYNTHESIS OF OLIGOPEPTIDES FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1984-07-03 US disclosed
US-4354966-A Peptides, process for preparation thereof and use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-10-19 US disclosed
US-4311640-A ANTIBIOTIC FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-01-19 US disclosed
US-4304718-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-12-08 US disclosed
EP-0027260-A2 Peptides, processes for their preparation and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-04-22 EP disclosed
EP-0025842-A2 Peptides, process for their preparation, their pharmaceutical compositions and their intermediates FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-04-01 EP disclosed
US-4237305-A INTERMEDIATES FOR PREPARING NEW ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-12-02 US disclosed
JP-S5545721-A EXPANDABLE STYRENE-BASED POLYMER BEADS AND PREPARATION OF THE SAME DENKI KAGAKU KOGYO KK 1980-03-31 JP disclosed
US-4181800-A ANTIBIOTICS FROM SUBSTITUTED PERHYDRO-S-TRIAZINES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-01-01 US disclosed
US-4164571-A Medicament which antagonizes the action of gastrin and related polypeptides COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 1979-08-14 US disclosed