SCHEMBL24028623

SCHEMBL24028623

COc1ccc2c(Oc3ccc(S(=N)(=O)NCC(=O)O)cc3)ccnc2c1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 0.48
MET P08581 4/20 0.48
AURKA O14965 3/20 0.48
TEK Q02763 3/20 0.48
AURKB Q96GD4 1/20 0.48
PDGFRA P16234 3/20 0.46
CSF1R P07333 10/20 0.45
PDGFRB P09619 10/20 0.45
FLT3 P36888 2/20 0.45
MAPT P10636 1/20 0.44

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
SCHEMBL25465678 0.88 KDR (0.48) KDRMETAURKATEKAURKB
SCHEMBL24028343 0.88 KDR (0.48) KDRMETAURKATEKAURKB
SCHEMBL24028342 0.88 KDR (0.46) KDRMETAURKATEKAURKB
SCHEMBL25466877 0.86 KDR (0.46) KDRMETAURKATEKAURKB
SCHEMBL24028356 0.85 KDR (0.49) KDRMETAURKATEKAURKB
SCHEMBL24028621 0.85 KDR (0.45) KDRMETAURKATEKAURKB
SCHEMBL24028628 0.85 KDR (0.45) KDRMETAURKATEKAURKB
SCHEMBL25466880 0.85 KDR (0.45) KDRMETAURKATEKAURKB
SCHEMBL25467199 0.85 KDR (0.45) KDRMETAURKATEKAURKB
SCHEMBL24028341 0.84 KDR (0.48) 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 2 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
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.