SCHEMBL23993117

SCHEMBL23993117

COC[C@H]1C[C@@H]1c1cc(-c2cnc(OC)nc2OC)nn2ccnc12

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 15/20 0.35
▸ MTOR P42345 2/20 0.35
▸ PPARD Q03181 1/20 0.33
▸ SYK P43405 2/20 0.32
▸ PIK3CD O00329 1/20 0.32
▸ ABL1 P00519 1/20 0.32
▸ EGFR P00533 1/20 0.32
▸ HCK P08631 1/20 0.32
▸ SRC P12931 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ PIK3CB P42338 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ EPHB4 P54760 1/20 0.32
▸ PRKDC P78527 1/20 0.32
▸ PI4KB Q9UBF8 1/20 0.32

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
SCHEMBL29467425 0.90 MTOR (0.36) PDE10AMTORPPARDSYKPIK3CD
SCHEMBL23994838 0.87 SYK (0.36) PDE10AMTORPPARDSYK
SCHEMBL23994841 0.87 SYK (0.36) PDE10AMTORPPARDSYK
SCHEMBL23993207 0.85 MDM2 (0.37) PDE10A
SCHEMBL30224137 0.85 MDM2 (0.37) PDE10A
SCHEMBL30181590 0.84 MTOR (0.35) MTORPPARDSYKPIK3CDABL1
SCHEMBL23993405 0.84 MTOR (0.35) MTORPPARDSYKPIK3CDABL1
SCHEMBL29467452 0.84 MTOR (0.37) MTORPPARDSYKPIK3CDABL1
SCHEMBL23994049 0.83 CYP1A2 (0.37) MTORPPARDSYKPIK3CDABL1
SCHEMBL23994054 0.83 CYP1A2 (0.37) MTORPPARDSYKPIK3CDABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4143194-A1 CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 2023-03-08 — — EP disclosed
US-20230039553-A1 CD73 COMPOUNDS GILEAD SCIENCES, INC. 2023-02-09 — — US disclosed
WO-2021222522-A1 CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 2021-11-04 — — 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-20230039553-A1 CD73 COMPOUNDS ENTPD5, ENTPD1, NT5E PDE10A 484/4885MTOR 1667/4885PPARD 2945/4885

“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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