SCHEMBL24671087

SCHEMBL24671087

COC(=O)c1ccc(C2=CCN(C(=O)OC(C)(C)C)CC2)s1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDK4 Q16654 1/20 0.50
NAMPT P43490 1/20 0.49
GRM1 Q13255 11/20 0.47
GRM5 P41594 11/20 0.47
HTR6 P50406 1/20 0.44
JAK1 P23458 1/20 0.43
KIT P10721 2/20 0.43
GPR119 Q8TDV5 1/20 0.43
NR1H2 P55055 1/20 0.42

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
SCHEMBL1061832 0.91 PDK4 (0.52) PDK4NAMPTGRM1GRM5HTR6
SCHEMBL31283668 0.88 PDK4 (0.52) PDK4NAMPTGRM1GRM5HTR6
SCHEMBL15376949 0.88 PDK4 (0.50) PDK4NAMPTGRM1GRM5HTR6
SCHEMBL28668463 0.83 PDK4 (0.54) PDK4NAMPTGRM1GRM5HTR6
SCHEMBL24669280 0.83 NAMPT (0.62) PDK4NAMPTGRM1GRM5JAK1
SCHEMBL19703165 0.82 PDK4 (0.53) PDK4NAMPTGRM1GRM5HTR6
SCHEMBL30779416 0.81 PDK4 (0.52) PDK4NAMPTGRM1GRM5HTR6
SCHEMBL5223668 0.80 NAMPT (0.49) PDK4NAMPTGRM1GRM5HTR6
SCHEMBL23013306 0.80 QDPR (0.43) HTR6
SCHEMBL2951348 0.80 NAMPT (0.60) PDK4NAMPTGRM1GRM5HTR6

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-20230142338-A1 THIOPHENYL DERIVATIVES USEFUL FOR MODULATING NUCLEIC ACID SPLICING REMIX THERAPEUTICS INC. 2023-05-11 US disclosed
EP-4110775-A1 THIOPHENYL DERIVATIVES USEFUL FOR MODULATING NUCLEIC ACID SPLICING Remix Therapeutics Inc. (US) 2023-01-04 EP disclosed
WO-2022192162-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) 2022-09-15 WO disclosed
WO-2022192162-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) 2022-09-15 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-20230142338-A1 THIOPHENYL DERIVATIVES USEFUL FOR MODULATING NUCLEIC ACID SPLICING SNRPA, NSUN3, NSUN2 PDK4 2384/4885NAMPT 1626/4885GRM1 2621/4885

“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.