SCHEMBL17633822

SCHEMBL17633822

CC(=O)Nc1ccc(C(=O)NCCSCC(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.56
NFKB1 P19838 1/20 0.56
KCNH2 Q12809 1/20 0.56
SMN1; SMN2 Q16637 4/20 0.54
POLB P06746 2/20 0.54
CYP3A4 P08684 1/20 0.54
THRB P10828 1/20 0.54
BLM P54132 1/20 0.54
ATM Q13315 1/20 0.54
HTT P42858 2/20 0.53
GAA P10253 1/20 0.52
CACNA1B Q00975 1/20 0.51
APBA1 Q02410 1/20 0.51
KDM4E B2RXH2 2/20 0.48
EPHX2 P34913 1/20 0.48
NR1H4 Q96RI1 1/20 0.48
TP53 P04637 1/20 0.48
HIF1A Q16665 1/20 0.48
LMNA P02545 2/20 0.47
CA12 O43570 1/20 0.46

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
SCHEMBL17633763 0.82 SMN1; SMN2 (0.63) ALDH1A1NFKB1KCNH2SMN1; SMN2POLB
SCHEMBL135088 0.81 ALDH1A1 (0.62) ALDH1A1NFKB1KCNH2SMN1; SMN2POLB
SCHEMBL5508324 0.77 ALDH1A1 (0.70) ALDH1A1NFKB1KCNH2SMN1; SMN2POLB
SCHEMBL6941062 0.77 CACNA1B (0.62) ALDH1A1NFKB1KCNH2SMN1; SMN2POLB
SCHEMBL17633853 0.77 POLB (0.71) ALDH1A1SMN1; SMN2POLBHTTKDM4E
SCHEMBL11196763 0.76 ALDH1A1 (0.64) ALDH1A1NFKB1KCNH2SMN1; SMN2POLB
SCHEMBL11657971 0.76 GAA (0.50) ALDH1A1SMN1; SMN2POLBHTTGAA
SCHEMBL5502874 0.75 SMN1; SMN2 (0.79) ALDH1A1NFKB1KCNH2SMN1; SMN2POLB
SCHEMBL17633847 0.75 NPC1 (0.62) ALDH1A1NFKB1SMN1; SMN2LMNAHPGD
SCHEMBL10755432 0.74 RAB9A (0.68) ALDH1A1NFKB1KCNH2SMN1; SMN2CACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230404947-A1 COMPOSITIONS, METHODS OF TREATMENT, AND CONTAINERS INCLUDING COMPOSITIONS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2023-12-21 US disclosed
US-20230338310-A1 ANTI-VIRAL THERAPY NOVABIOTICS LIMITED (GB) 2023-10-26 US disclosed
US-11771665-B2 Compositions, methods of treatment, and containers including compositions UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2023-10-03 US disclosed
EP-4157247-A1 ANTI-VIRAL THERAPY Novabiotics Limited (GB) 2023-04-05 EP disclosed
US-20220347126-A1 COMPOSITIONS, METHODS OF TREATMENT, AND CONTAINERS INCLUDING COMPOSITIONS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2022-11-03 US disclosed
US-11369568-B2 Microparticles comprising a sulphur-containing compound NOVABIOTICS LIMITED (GB) 2022-06-28 US disclosed
WO-2021240145-A1 ANTI-VIRAL THERAPY NOVABIOTICS LIMITED (GB) 2021-12-02 WO disclosed
WO-2021203136-A1 METHODS FOR TREATING HYPERPIGMENTATION AND COMPOSITIONS FOR SAME CHEMISTRYRX (US) 2021-10-07 WO disclosed
US-20210299019-A1 METHODS FOR TREATING HYPERPIGMENTATION AND COMPOSITIONS FOR SAME CHEMISTRYRX (US) 2021-09-30 US disclosed
US-10905660-B2 Microparticles NOVABIOTICS LIMITED (GB) 2021-02-02 US disclosed
US-20180344671-A1 Cysteamine as Neutrophil Elastase Inhibitor NOVABIOTICS LIMITED (GB) 2018-12-06 US disclosed
US-20180185305-A1 An Amino Thiol for Use in the Treatment of an Infection Caused by the Bacterium Mycobacterium Spp NOVABIOTICS LIMITED (GB) 2018-07-05 US disclosed
EP-3307259-A1 AN AMINO THIOL FOR USE IN THE TREATMENT OF AN INFECTION CAUSED BY THE BACTERIUM MYCOBACTERIUM SPP. Novabiotics Limited (GB) 2018-04-18 EP disclosed
WO-2017212239-A1 TREATMENT OF DRUG-RESISTANT MICROBIAL INFECTIONS NOVABIOTICS LIMITED (GB) 2017-12-14 WO disclosed
US-20170348254-A1 MICROPARTICLES NOVABIOTICS LIMITED (GB) 2017-12-07 US disclosed
US-20170348253-A1 Treatment of Drug-Resistant Microbial Infections NOVABIOTICS LIMITED (GB) 2017-12-07 US disclosed
EP-3197476-A1 USE OF CYSTEAMINE IN TREATING INFECTIONS CAUSED BY YEASTS/MOULDS Novabiotics Limited (GB) 2017-08-02 EP disclosed
WO-2016198842-A1 AN AMINO THIOL FOR USE IN THE TREATMENT OF AN INFECTION CAUSED BY THE BACTERIUM MYCOBACTERIUM SPP. NOVABIOTICS LIMITED (GB) 2016-12-15 WO disclosed
US-20160102052-A1 Use of Cysteamine in Treating Infections caused by Yeasts/Moulds NOVABIOTICS LIMITED (GB) 2016-04-14 US disclosed
WO-2016046524-A1 USE OF CYSTEAMINE IN TREATING INFECTIONS CAUSED BY YEASTS/MOULDS NOVABIOTICS LIMITED (GB) 2016-03-31 WO 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 (1 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-20230338310-A1 ANTI-VIRAL THERAPY MAVS, HAVCR2, IRF3 ALDH1A1 2213/4885NFKB1 151/4885KCNH2 3029/4885

“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.