SCHEMBL1649708

SCHEMBL1649708

CS(=O)(=O)O.NC(N)=Nc1ccc(C(=O)Oc2ccc(CC(=O)O)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 known ✓ P00734 5/20 0.69
ADRA1A known ✓ P35348 1/20 0.60
PRSS1 P07477 12/20 1.00
KLK1 P06870 4/20 1.00
TMPRSS2 O15393 2/20 0.86
ACR P10323 7/20 0.73
TMPRSS15 P98073 4/20 0.73
PRSS2 P07478 4/20 0.65
PRSS3 P35030 4/20 0.65
HGFAC Q04756 3/20 0.64
PLG P00747 1/20 0.60
FTO Q9C0B1 1/20 0.60
SLC22A2 O15244 1/20 0.60
HPN P05981 1/20 0.60
CTSL P07711 1/20 0.60
CNR1 P21554 1/20 0.60
OPRD1 P41143 1/20 0.60
KCNH2 Q12809 1/20 0.60
SLC47A2 Q86VL8 1/20 0.60
SLC47A1 Q96FL8 1/20 0.60

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
Camostat SCHEMBL29376746 0.82 PRSS1 (1.00) PRSS1KLK1TMPRSS2ACRTMPRSS15
SCHEMBL11417275 0.80 PRSS1 (0.67) PRSS1KLK1TMPRSS2ACRTMPRSS15
SCHEMBL20008707 0.78 PRSS1 (0.71) PRSS1KLK1TMPRSS2ACRTMPRSS15
SCHEMBL28467251 0.76 PRSS1 (0.61) PRSS1KLK1TMPRSS2ACRTMPRSS15
SCHEMBL20008700 0.76 PRSS1 (0.88) PRSS1KLK1TMPRSS2ACRTMPRSS15
SCHEMBL20008706 0.76 PRSS1 (1.00) PRSS1KLK1TMPRSS2ACRTMPRSS15
SCHEMBL30627528 0.76 PLG (1.00) PRSS1ACRTMPRSS15F2PRSS2
Nafamostat SCHEMBL25197320 0.75 FTO (1.00) PRSS1KLK1TMPRSS2ACRTMPRSS15
Nafamostat SCHEMBL1650158 0.75 FTO (1.00) PRSS1KLK1TMPRSS2ACRTMPRSS15
SCHEMBL4752931 0.75 PRSS1 (0.61) PRSS1KLK1TMPRSS2TMPRSS15F2

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12569456-B2 Methods for the treatment of cysteamine sensitive disorders THIOGENESIS THERAPEUTICS, INC. (US) 2026-03-10 US disclosed
EP-4534527-A2 METHODS FOR THE TREATMENT OF CYSTEAMINE SENSITIVE DISORDERS Thiogenesis Therapeutics, Inc. (US) 2025-04-09 EP disclosed
EP-3684418-B1 COMPOUNDS FOR THE TREATMENT OF CYSTEAMINE SENSITIVE DISORDERS THIOGENESIS THERAPEUTICS INC (US) 2025-02-12 EP disclosed
CN-118924717-A Methods for treating cysteamine-sensitive disorders 硫创治疗公司 2024-11-12 CN disclosed
CN-111683684-B Methods for treating cysteamine-sensitive disorders 硫创治疗公司 2024-07-02 CN disclosed
CN-117599029-A Compositions for controlled release of cysteamine and systematic treatment of cysteamine-sensitive disorders 硫创治疗公司 2024-02-27 CN disclosed
US-11786491-B2 Compositions for controlled release of cysteamine and systemic treatment of cysteamine sensitive disorders THIOGENESIS THERAPEUTICS, INC. (US) 2023-10-17 US disclosed
US-20230218571-A1 CYSTEAMINE PRECURSOR COMPOUNDS FOR THE TREATMENT OF BETACORONAVIRUS INFECTIONS THIOGENESIS THERAPEUTICS, INC. 2023-07-13 US disclosed
US-20230190683-A1 METHODS FOR THE TREATMENT OF CYSTEAMINE SENSITIVE DISORDERS THIOGENESIS THERAPEUTICS, INC. 2023-06-22 US disclosed
CN-115884764-A Cysteamine precursor compounds for treating coronavirus b infection 硫创治疗公司 2023-03-31 CN disclosed
US-11612576-B2 Methods for the treatment of cysteamine sensitive disorders THIOGENESIS THERAPEUTICS, INC. (US) 2023-03-28 US disclosed
EP-4125839-A1 CYSTEAMINE PRECURSOR COMPOUNDS FOR THE TREATMENT OF BETACORONAVIRUS INFECTIONS Thiogenesis Therapeutics, Inc. (US) 2023-02-08 EP disclosed
US-20220040127-A1 COMPOSITIONS FOR CONTROLLED RELEASE OF CYSTEAMINE AND SYSTEMIC TREATMENT OF CYSTEAMINE SENSITIVE DISORDERS THIOGENESIS THERAPEUTICS, INC. 2022-02-10 US disclosed
US-7927613-B2 Pharmaceutical co-crystal compositions UNIVERSITY OF SOUTH FLORIDA (US) 2011-04-19 US disclosed
US-7790905-B2 Pharmaceutical propylene glycol solvate compositions MCNEIL-PPC, INC. (US) 2010-09-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12569456-B2 Methods for the treatment of cysteamine sensitive disorders SLC7A11, CTH, SLC19A1 F2 643/4885ADRA1A 1789/4885PRSS1 888/4885
US-20230218571-A1 CYSTEAMINE PRECURSOR COMPOUNDS FOR THE TREATMENT OF BETACORONAVIRUS INFECTIONS CBS, CTH, BHMT F2 1380/4885ADRA1A 1327/4885PRSS1 67/4885
US-11612576-B2 Methods for the treatment of cysteamine sensitive disorders CTH, CBS, SLC19A1 F2 406/4885ADRA1A 2367/4885PRSS1 547/4885
US-20230190683-A1 METHODS FOR THE TREATMENT OF CYSTEAMINE SENSITIVE DISORDERS CTH, CBS, SLC19A1 F2 406/4885ADRA1A 2367/4885PRSS1 547/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.