SCHEMBL23993065

SCHEMBL23993065

COc1ncc(-c2cc([C@H]3C[C@@H]3c3ccccc3OC(F)(F)F)c3nccn3n2)c(OC)n1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 4/20 0.36
▸ PDE10A Q9Y233 2/20 0.34
▸ RAF1 P04049 3/20 0.33
▸ PDE2A O00408 1/20 0.32
▸ ACP1 P24666 1/20 0.32
▸ MTOR P42345 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ METAP2 P50579 1/20 0.31
▸ RIPK1 Q13546 4/20 0.31
▸ MDM2 Q00987 1/20 0.31
▸ PPARD Q03181 1/20 0.30
▸ TNK2 Q07912 1/20 0.30

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
SCHEMBL30181713 1.00 SYK (0.36) SYKPDE10ARAF1PDE2AACP1
SCHEMBL30182002 0.91 SYK (0.41) SYKPDE10ARAF1ACP1MTOR
SCHEMBL25005777 0.91 SYK (0.41) SYKPDE10ARAF1ACP1MTOR
SCHEMBL23994827 0.91 SYK (0.41) SYKPDE10ARAF1ACP1MTOR
SCHEMBL23995137 0.87 RAF1 (0.32) SYKRAF1MTORMDM2
SCHEMBL30224707 0.86 PDE10A (0.35) PDE10AMTORPPARD
SCHEMBL30224302 0.86 ABL1 (0.34) SYKRAF1MTORCYP1A2METAP2
SCHEMBL23993110 0.86 ABL1 (0.34) SYKRAF1MTORCYP1A2METAP2
SCHEMBL23993837 0.86 PDE10A (0.35) PDE10AMTORPPARD
SCHEMBL23992888 0.86 PDE10A (0.34) SYKPDE10ARAF1PPARD

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-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 SYK 2578/4885PDE10A 484/4885RAF1 2499/4885

“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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