SCHEMBL30446173

SCHEMBL30446173

COc1cc2nccc(-c3ccc(CNS(N)(=O)=O)c(F)c3)c2cc1OC

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 12/20 0.54
ENPP3 O14638 1/20 0.54
KIT P10721 4/20 0.42
FLT3 P36888 1/20 0.41
MET P08581 1/20 0.40
BTK Q06187 1/20 0.40

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
SCHEMBL20782586 1.00 ENPP1 (0.54) ENPP1ENPP3KITFLT3MET
SCHEMBL20770862 0.87 ENPP1 (0.73) ENPP1ENPP3METBTK
SCHEMBL22407333 0.84 ENPP1 (0.74) ENPP1ENPP3
SCHEMBL20782677 0.84 ENPP1 (0.68) ENPP1KIT
SCHEMBL25681687 0.84 MET (0.46) KITFLT3MET
SCHEMBL22407529 0.83 FLT3 (0.42) KITFLT3METBTK
SCHEMBL20782623 0.82 ENPP1 (0.69) ENPP1ENPP3MET
SCHEMBL20782441 0.81 ENPP1 (0.71) ENPP1ENPP3
SCHEMBL20782741 0.80 ENPP1 (0.74) ENPP1ENPP3FLT3
SCHEMBL22407357 0.77 ENPP1 (0.66) ENPP1ENPP3FLT3MET

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-20230183239-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE 1 (ENPP-1) INHIBITORS AND USES THEREOF ABBVIE INC (US) 2023-06-15 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-20230183239-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE 1 (ENPP-1) INHIBITORS AND USES THEREOF ENPP1, ENPP3, STING1 ENPP1 1/4885ENPP3 2/4885KIT 4057/4885

“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.