SCHEMBL460107

SCHEMBL460107

Cc1ccccc1S(=O)(=O)N[N]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
TDP1 Q9NUW8 2/20 0.49
TP53 P04637 1/20 0.49
EDNRA P25101 2/20 0.47
RXFP1 Q9HBX9 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SLC1A3 P43003 1/20 0.46
SLC1A2 P43004 1/20 0.46
SLC1A1 P43005 1/20 0.46
SLC22A12 Q96S37 2/20 0.45
PKM P14618 2/20 0.45
LMNA P02545 2/20 0.45
HTT P42858 2/20 0.45
KAT6A Q92794 1/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.45
EDNRB P24530 1/20 0.45
SLC40A1 Q9NP59 1/20 0.44
BRD4 O60885 1/20 0.43

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
SCHEMBL6927887 0.82 EDNRA (0.54) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL634340 0.80 LMNA (0.57) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL30338563 0.80 LMNA (0.57) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL31268095 0.78 SLC1A3 (0.50) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL297109 0.78 ALDH1A1 (0.51) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL7630639 0.78 EDNRA (0.49) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL10530500 0.78 ALDH1A1 (0.49) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL4636106 0.78 CA1 (0.55) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL7162191 0.78 ALDH1A1 (0.49) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL420849 0.78 SLC1A3 (0.50) ALDH1A1TDP1TP53EDNRARXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0103840-B1 METHOD FOR PREPARING 1,2,3-TRIHETERO 5-MEMBERED HETEROCYCLIC COMPOUNDS LEDERLE (JAPAN) LTD. (JP) 1987-03-04 EP claimed
US-4540794-A Method for preparing 5-mercapto-1,2,3-thiadiazole salts LEDERLE (JAPAN), LTD. (JP) 1985-09-10 US claimed
EP-0103840-A2 Method for preparing 1,2,3-trihetero 5-membered heterocyclic compounds LEDERLE (JAPAN) LTD. (JP) 1984-03-28 EP claimed
JP-56108723-A None JP disclosed
EP-4297746-A2 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF SUBOPTIMALLY ADMINISTERED COMPOUNDS AND THERAPIES FOR THE TREATMENT OF DISEASES Edison Oncology (US) 2024-01-03 EP disclosed
WO-2023104656-A1 METHOD FOR SEPARATING GASEOUS CARBON DIOXIDE FROM A GAS MIXTURE CLIMEWORKS AG (CH) 2023-06-15 WO disclosed
CN-111851085-A Foamed resin layer and synthetic leather 本田技研工业株式会社 2020-10-30 CN disclosed
WO-2012154906-A1 TOTAL SYNTHESIS OF ARTEMISININ INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2012-11-15 WO disclosed
US-20120021933-A1 SMALL MOLECULE PRINTING PARK SEUNG BUM (US) 2012-01-26 US disclosed
US-7932213-B2 Solid phase synthesis with benzylidene linker attaching compound on glass slide; microarrays; drug screening PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2011-04-26 US disclosed
EP-2027133-B1 NOVEL SILANE COMPOUNDS HAVING A HYDRAZONE OR DIAZO FUNCTION FOR FUNCTIONALISING SOLID SUPPORTS AND IMMOBILISING BIOLOGICAL MOLECULES THEREON COMMISSARIAT ENERGIE ATOMIQUE (FR) 2010-12-29 EP disclosed
EP-0224823-A2 Quinoline derivatives and their use in combating unwanted plant growth BASF Aktiengesellschaft (DE) 1987-06-10 EP disclosed
EP-0103840-B1 METHOD FOR PREPARING 1,2,3-TRIHETERO 5-MEMBERED HETEROCYCLIC COMPOUNDS LEDERLE (JAPAN) LTD. (JP) 1987-03-04 EP disclosed
US-4540794-A Method for preparing 5-mercapto-1,2,3-thiadiazole salts LEDERLE (JAPAN), LTD. (JP) 1985-09-10 US disclosed
US-4479964-A CONTRACEPTIVES ORTHO PHARMACEUTICAL CORPORATION (US) 1984-10-30 US disclosed
EP-0103840-A2 Method for preparing 1,2,3-trihetero 5-membered heterocyclic compounds LEDERLE (JAPAN) LTD. (JP) 1984-03-28 EP disclosed
US-4408060-A UTERO-EVACUANTS ORTHO PHARMACEUTICAL CORPORATION (US) 1983-10-04 US disclosed
JP-S56108723-A PREPARATION OF INDENE DERIVATIVE IWAKI SEIYAKU KK 1981-08-28 JP disclosed
US-4176188-A SUBSTITUTED OXEPANE ORTHO PHARMACEUTICAL CORP. (US) 1979-11-27 US disclosed
US-4102895-A Oxepanes ORTHO PHARMACEUTICAL CORPORATION (US) 1978-07-25 US disclosed