SCHEMBL9044248

SCHEMBL9044248

CC(C)(C)SCC(NS)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
ALOX15 P16050 1/20 0.35
NFKB1 P19838 1/20 0.35
PTGS2 P35354 1/20 0.35
THPO P40225 1/20 0.35
RECQL P46063 1/20 0.35
BLM P54132 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
METAP2 P50579 1/20 0.35
METAP1 P53582 1/20 0.35
KIF11 P52732 1/20 0.34
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
FOLH1 Q04609 2/20 0.31
NAALAD2 Q9Y3Q0 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MME P08473 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
SCHEMBL25454656 0.82 KIF11 (0.35) ACEKDM4EMAPTTHRBALOX15
SCHEMBL13660678 0.82 KIF11 (0.35) ACEKDM4EMAPTTHRBALOX15
SCHEMBL26607647 0.80 KIF11 (0.34) ACEKDM4EMAPTTHRBALOX15
SCHEMBL31575454 0.79
SCHEMBL8345830 0.79
SCHEMBL25453286 0.78 ACE (0.35) ACEKDM4EMAPTTHRBALOX15
SCHEMBL25455682 0.78 ACE (0.35) ACEKDM4EMAPTTHRBALOX15
SCHEMBL7615672 0.78 MAPT (0.52) ACEKDM4EMAPTTHRBALOX15
SCHEMBL25454658 0.78 METAP2 (0.34) ACEKDM4EMAPTTHRBALOX15
SCHEMBL12229221 0.78 MAPT (0.52) ACEKDM4EMAPTTHRBALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025096930-A1 AMINO-ACID- AND AMINO-ALCOHOL-BASED POLYAMINE COMPOUNDS AND MEDICAL HYDROGELS FORMED THEREFROM BOSTON SCIENTIFIC SCIMED, INC. (US) 2025-05-08 WO disclosed
US-20250136760-A1 AMINO-ACID- AND AMINO-ALCOHOL-BASED POLYAMINE COMPOUNDS AND MEDICAL HYDROGELS FORMED THEREFROM BOSTON SCIENTIFIC SCIMED, INC. (US) 2025-05-01 US disclosed
EP-0698015-A1 PREPARATION OF N-CYANODITHIOIMINO-CARBONATES AND 3-MERCAPTO-5-AMINO-1H-1,2,4-TRIAZOLE GENENTECH, INC. (US) 1996-02-28 EP 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-20250136760-A1 AMINO-ACID- AND AMINO-ALCOHOL-BASED POLYAMINE COMPOUNDS AND MEDICAL HYDROGELS FORMED THEREFROM CARM1, PNMT, ADM2 ACE 3581/4885KDM4E 1248/4885MAPT 2826/4885

“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.