SCHEMBL21855428

SCHEMBL21855428

O=S(=O)([O-])CCC[N+](CCO)(CCO)CCO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 3/20 0.52
GMNN O75496 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
THPO P40225 1/20 0.39
HBB P68871 1/20 0.39
PMP22 Q01453 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
ENPEP Q07075 1/20 0.31
APAF1 O14727 1/20 0.30
POLB P06746 1/20 0.30
GRK2 P25098 1/20 0.30
DNMT1 P26358 1/20 0.30
PTPN7 P35236 1/20 0.30

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
SCHEMBL1608022 0.93 BBOX1 (0.45) BBOX1GMNNALDH1A1LMNATP53
SCHEMBL22616415 0.90 BBOX1 (0.48) BBOX1ALDH1A1TP53TSHRSMN1; SMN2
SCHEMBL29206222 0.86 BBOX1 (0.40) BBOX1GMNNALDH1A1LMNATP53
SCHEMBL11879870 0.82 SLC22A1 (0.48) ALDH1A1TP53TSHRSMN1; SMN2ALOX15
SCHEMBL9785032 0.81 SLC22A1 (0.46) BBOX1ALDH1A1TP53TSHRSMN1; SMN2
Tetrabuthylammonium SCHEMBL8846092 0.79 SLC22A1 (0.46) BBOX1ALDH1A1LMNATP53TSHR
SCHEMBL11244311 0.79 APP (0.42) LMNABLM
SCHEMBL16211685 0.78 BBOX1 (0.64) BBOX1GMNNALDH1A1LMNATP53
SCHEMBL16736475 0.74 BBOX1 (0.65) BBOX1GMNNALDH1A1LMNATP53
Sulfuric Acid SCHEMBL4411418 0.74 SLC22A1 (0.54) ALDH1A1TP53TSHRSMN1; SMN2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250304604-A1 ORGANOSILANES FOR THE TREATMENT OF INFECTIONS TOPIKOS SCIENTIFIC, INC. (US) 2025-10-02 US disclosed
US-12180239-B2 Organosilanes for the treatment of infections TOPIKOS SCIENTIFIC, INC. (US) 2024-12-31 US disclosed
US-20210253607-A1 ORGANOSILANES FOR THE TREATMENT OF INFECTIONS TOPIKOS PHARMACEUTICALS, INC. (US) 2021-08-19 US disclosed
WO-2020082026-A1 ORGANOSILANES FOR THE TREATMENT OF INFECTIONS TOPIKOS PHARMACEUTICALS, INC. (US) 2020-04-23 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 (3 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-20210253607-A1 ORGANOSILANES FOR THE TREATMENT OF INFECTIONS ASNS, ACMSD, ARG1 BBOX1 2621/4885GMNN 808/4885ALDH1A1 1902/4885
US-12180239-B2 Organosilanes for the treatment of infections ASNS, ACMSD, ARG1 BBOX1 2621/4885GMNN 808/4885ALDH1A1 1902/4885
US-20250304604-A1 ORGANOSILANES FOR THE TREATMENT OF INFECTIONS ASNS, ACMSD, ARG1 BBOX1 2621/4885GMNN 808/4885ALDH1A1 1902/4885

“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.