SCHEMBL22164793

SCHEMBL22164793

COc1cc2ncnc(Oc3ccc(CP(=O)(O)O)cc3)c2cc1OC

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 9/20 0.60
▸ PDGFRB P09619 9/20 0.60
▸ FLT4 P35916 8/20 0.60
▸ PDGFRA P16234 1/20 0.59
▸ FLT3 P36888 7/20 0.58
▸ CSF1R P07333 4/20 0.58
▸ RET P07949 1/20 0.56
▸ KIF5B P33176 1/20 0.56
▸ LCK P06239 1/20 0.55

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
SCHEMBL24262961 0.89 KDR (0.58) KDRPDGFRBFLT4PDGFRAFLT3
SCHEMBL29397934 0.85 KDR (0.58) KDRPDGFRBFLT4PDGFRAFLT3
SCHEMBL22169946 0.85 KDR (0.58) KDRPDGFRBFLT4PDGFRAFLT3
SCHEMBL22164824 0.84 PDGFRB (0.64) KDRPDGFRBFLT4PDGFRAFLT3
SCHEMBL1097832 0.82 PDGFRB (0.67) KDRPDGFRBFLT4PDGFRAFLT3
SCHEMBL20771410 0.82 PDGFRB (0.67) KDRPDGFRBFLT4PDGFRAFLT3
SCHEMBL22165252 0.82 PDGFRB (0.64) KDRPDGFRBFLT4PDGFRAFLT3
SCHEMBL5177524 0.81 PDGFRB (0.66) KDRPDGFRBFLT4PDGFRAFLT3
SCHEMBL1099346 0.81 PDGFRB (0.66) KDRPDGFRBFLT4PDGFRAFLT3
SCHEMBL22165149 0.81 KIT (0.52) KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220056052-A1 QUINAZOLINE DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS RIBOSCIENCE LLC 2022-02-24 — — US disclosed
US-20220056052-A1 QUINAZOLINE DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS RIBOSCIENCE LLC 2022-02-24 — — US disclosed
EP-3902787-A1 QUINAZOLINE DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS Riboscience LLC (US) 2021-11-03 — — EP disclosed
WO-2020140001-A1 QUINAZOLINE DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS RIBOSCIENCE LLC (US) 2020-07-02 — — WO disclosed
WO-2020140001-A1 QUINAZOLINE DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS RIBOSCIENCE LLC (US) 2020-07-02 — — 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-20220056052-A1 QUINAZOLINE DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS ENPP1, ENPP3, PDE7A KDR 3712/4885PDGFRB 2961/4885FLT4 3776/4885

“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.

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