SCHEMBL30182002

SCHEMBL30182002

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

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 5/20 0.41
▸ ADRA1A P35348 1/20 0.35
▸ MTOR P42345 1/20 0.34
▸ ACP1 P24666 1/20 0.34
▸ PDE10A Q9Y233 2/20 0.33
▸ MDM2 Q00987 1/20 0.33
▸ PPARD Q03181 1/20 0.33
▸ QPCT Q16769 1/20 0.32
▸ QPCTL Q9NXS2 1/20 0.32
▸ JAK2 O60674 2/20 0.32
▸ HTR2A P28223 1/20 0.32
▸ HTR2C P28335 1/20 0.32
▸ HTR2B P41595 1/20 0.32
▸ FAAH O00519 1/20 0.32
▸ CES1 P23141 1/20 0.32
▸ PTGES2 Q9H7Z7 1/20 0.32
▸ JAK3 P52333 1/20 0.31
▸ RAF1 P04049 1/20 0.31

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
SCHEMBL23994827 1.00 SYK (0.41) SYKADRA1AMTORACP1PDE10A
SCHEMBL25005777 1.00 SYK (0.41) SYKADRA1AMTORACP1PDE10A
SCHEMBL23993065 0.91 SYK (0.36) SYKMTORACP1PDE10AMDM2
SCHEMBL30181713 0.91 SYK (0.36) SYKMTORACP1PDE10AMDM2
SCHEMBL23993918 0.90 SYK (0.38) SYKMTORACP1MDM2PPARD
SCHEMBL23995307 0.90 SYK (0.36) SYKMTORACP1MDM2PPARD
SCHEMBL23995304 0.90 SYK (0.36) SYKMTORACP1MDM2PPARD
SCHEMBL23994016 0.89 SYK (0.36) SYKMTORACP1MDM2PPARD
SCHEMBL30224464 0.89 SYK (0.36) SYKMTORACP1MDM2PPARD
SCHEMBL23993986 0.89 SYK (0.37) SYKMTORACP1PDE10AMDM2

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
US-12110294-B2 CD73 compounds GILEAD SCIENCES, INC. (US) 2024-10-08 — — US disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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 2578/4885ADRA1A 2855/4885MTOR 1667/4885
US-12110294-B2 CD73 compounds ENTPD5, ENTPD1, NT5E SYK 2691/4885ADRA1A 2354/4885MTOR 1715/4885

“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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