SCHEMBL22407381

SCHEMBL22407381

COc1cc2nccc(Oc3ccc(N[SH](=O)=O)cc3F)c2cc1OC

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FGFR2 P21802 1/20 0.66
PDGFRA P16234 2/20 0.62
MET P08581 13/20 0.61
AXL P30530 4/20 0.61
KDR P35968 3/20 0.61
FLT3 P36888 1/20 0.57

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
SCHEMBL22407477 0.87 PDGFRA (0.54) FGFR2PDGFRAMETAXLKDR
SCHEMBL22407579 0.87 MET (0.53) FGFR2PDGFRAMETKDR
SCHEMBL5049533 0.86 FGFR2 (0.71) FGFR2PDGFRAMETAXLKDR
SCHEMBL29822421 0.85 FGFR2 (0.67) FGFR2PDGFRAMETAXLKDR
SCHEMBL2573722 0.85 FGFR2 (0.67) FGFR2PDGFRAMETAXLKDR
SCHEMBL23617110 0.85 FGFR2 (0.67) FGFR2PDGFRAMETAXLKDR
SCHEMBL22407393 0.84 PDGFRA (0.54) FGFR2PDGFRAMETAXLKDR
SCHEMBL22407317 0.84 PDGFRA (0.59) FGFR2PDGFRAMETKDR
SCHEMBL22407555 0.83 FGFR2 (0.71) FGFR2PDGFRAAXLKDR
SCHEMBL5056203 0.83 PDGFRA (0.72) FGFR2PDGFRAMETAXLKDR

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 2 patents. 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
US-20200291024-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE 1 (ENPP-1) INHIBITORS AND USES THEREOF ABBVIE INC (US) 2020-09-17 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 (2 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-20200291024-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE 1 (ENPP-1) INHIBITORS AND USES THEREOF ENPP1, ENPP3, STING1 FGFR2 4496/4885PDGFRA 624/4885MET 3803/4885
US-20230183239-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE 1 (ENPP-1) INHIBITORS AND USES THEREOF ENPP1, ENPP3, STING1 FGFR2 4496/4885PDGFRA 624/4885MET 3803/4885

“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.