SCHEMBL24028704

SCHEMBL24028704

COc1ccc2c(Oc3ccc(S4(=O)=NCC(=O)N4)cc3)ccnc2c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 9/20 0.45
▸ MET P08581 5/20 0.45
▸ AURKA O14965 3/20 0.45
▸ TEK Q02763 3/20 0.45
▸ AURKB Q96GD4 1/20 0.45
▸ FGFR2 P21802 2/20 0.42
▸ PDGFRA P16234 3/20 0.41
▸ PDGFRB P09619 5/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ ALK Q9UM73 1/20 0.40
▸ AXL P30530 1/20 0.40
▸ CSF1R P07333 4/20 0.40
▸ FLT3 P36888 1/20 0.39

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
SCHEMBL24029089 0.83 MET (0.45) KDRMETAURKATEKAURKB
SCHEMBL29043511 0.74 KDR (0.45) KDRMETAURKATEKAURKB
SCHEMBL29043509 0.74 KDR (0.45) KDRMETAURKATEKAURKB
SCHEMBL25223294 0.73 KDR (0.45) KDRMETAURKATEKAURKB
SCHEMBL25466495 0.73 FGFR2 (0.60) KDRMETAURKATEKAURKB
SCHEMBL22435917 0.73 KDR (0.57) KDRMETAURKATEKAURKB
SCHEMBL29043514 0.72 FGFR2 (0.54) KDRMETAURKATEKAURKB
SCHEMBL14540594 0.72 KDR (0.57) KDRMETAURKATEKAURKB
SCHEMBL29262935 0.72 MET (0.58) KDRMETAURKATEKAURKB
SCHEMBL15537365 0.72 KDR (0.63) KDRMETAURKATEKAURKB

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-20230183188-A1 ENPP1 MODULATORS AND USES THEREOF Vir Biotechnology, Inc. 2023-06-15 — — US disclosed
US-20230183188-A1 ENPP1 MODULATORS AND USES THEREOF Vir Biotechnology, Inc. 2023-06-15 — — US disclosed
US-20230183188-A1 ENPP1 MODULATORS AND USES THEREOF Vir Biotechnology, Inc. 2023-06-15 — — US disclosed
WO-2021231726-A1 ENPP1 MODULATORS AND USES THEREOF Vir Biotechnology, Inc. (US) 2021-11-18 — — 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-20230183188-A1 ENPP1 MODULATORS AND USES THEREOF ENPP1, ENPP2, ENPP3 KDR 3650/4885MET 4868/4885AURKA 3548/4885

“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.

Send feedback