SCHEMBL26274192

SCHEMBL26274192

CNc1cccc([S+]([O-])c2cccc(NC)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
APP P05067 1/20 0.34
EGFR P00533 6/20 0.33
ERBB2 P04626 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
APAF1 O14727 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
PABPC1 P11940 1/20 0.33
MMP14 P50281 1/20 0.33
BLM P54132 1/20 0.33
CASP6 P55212 1/20 0.33
EPHB2 P29323 1/20 0.33
BRD4 O60885 1/20 0.33
IDH2 P48735 1/20 0.33
PLK1 P53350 1/20 0.32
MAPT P10636 2/20 0.32
MAPK1 P28482 1/20 0.32
NTRK1 P04629 1/20 0.31

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
SCHEMBL6847221 0.85 TSHR (0.41) TSHRAPPBRD4
SCHEMBL6848815 0.85 TSHR (0.41) TSHRAPPBRD4
SCHEMBL21691165 0.83 TSHR (0.39) TSHRAPPBRD4
Hydrochloric Acid SCHEMBL6841993 0.83 TSHR (0.39) TSHRAPPBRD4
SCHEMBL20048796 0.83 TSHR (0.39) TSHRAPPEGFRERBB2EPHB2
Hydrochloric Acid SCHEMBL6846381 0.83 TSHR (0.39) TSHRAPPBRD4
SCHEMBL20048797 0.83 TSHR (0.39) TSHRAPPBRD4
SCHEMBL628205 0.75 TSHR (0.61) TSHRAPPEGFRERBB2MEN1
SCHEMBL28015253 0.75 KEAP1 (0.52) TSHRNPC1POLBBRD4MAPK1
Hydrochloric Acid SCHEMBL5151093 0.73 TSHR (0.58) TSHRAPPEGFRERBB2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295198-A1 VANILLIN-DERIVED FLAME RETARDANT MONOMERS, RESINS, PREPOLYMERS, AND POLYMERS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2023-09-21 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 (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-20230295198-A1 VANILLIN-DERIVED FLAME RETARDANT MONOMERS, RESINS, PREPOLYMERS, AND POLYMERS PNN, PFAS, POLN TSHR 4141/4885APP 1294/4885EGFR 4416/4885

“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.