SCHEMBL25243745

SCHEMBL25243745

C[C@@H]1COCCN1c1nc(Cl)nc2c1ncn2S(C)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 5/20 0.48
▸ ATR Q13535 17/20 0.46
▸ ATRIP Q8WXE1 15/20 0.46
▸ PIK3CA P42336 3/20 0.44
▸ LCK P06239 2/20 0.44
▸ NUAK1 O60285 1/20 0.44
▸ PRKDC P78527 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ PIK3CD O00329 2/20 0.41
▸ CHEK1 O14757 2/20 0.41
▸ PDCD1 Q15116 1/20 0.41
▸ CD274 Q9NZQ7 1/20 0.41

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
SCHEMBL25292440 1.00 MTOR (0.48) MTORATRATRIPPIK3CALCK
SCHEMBL25080403 0.90 MTOR (0.48) MTORATRATRIPPIK3CAPIK3CD
SCHEMBL1611443 0.83 MTOR (0.53) MTORATRPIK3CAATMPIK3CD
SCHEMBL1611445 0.83 MTOR (0.53) MTORATRPIK3CAATMPIK3CD
SCHEMBL2673181 0.83 MTOR (0.53) MTORATRPIK3CAATMPIK3CD
SCHEMBL25287665 0.82 ATR (0.43) MTORATRATRIPCHEK1PDCD1
SCHEMBL25287322 0.82 ATR (0.52) MTORATRATRIPPIK3CALCK
SCHEMBL25242204 0.82 ATR (0.43) MTORATRATRIPCHEK1PDCD1
SCHEMBL25249667 0.82 ATR (0.52) MTORATRATRIPPIK3CALCK
SCHEMBL30443159 0.82 ATR (0.43) MTORATRATRIPCHEK1PDCD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12435095-B2 Substituted morpholines as ATR kinase inhibitors SHANGHAI ANNOVA BIOTECHNOLOGY CO., LTD. (CN) 2025-10-07 — — US disclosed
CN-116761804-B Substituted condensed heterocyclic compound, preparation method and application thereof 上海安诺达生物科技有限公司 2025-02-18 — — CN disclosed
US-20250051362-A1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI ANNOVA BIOTECHNOLOGY CO., LTD. (CN) 2025-02-13 — — US disclosed
EP-4455144-A1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Annova Biotechnology Co., Ltd. (CN) 2024-10-30 — — EP disclosed
CN-116761804-A Substituted condensed heterocyclic compound, preparation method and application thereof 上海安诺达生物科技有限公司 2023-09-15 — — CN disclosed
WO-2023116594-A1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海安诺达生物科技有限公司 2023-06-29 — — WO disclosed
WO-2023116594-A1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海安诺达生物科技有限公司 2023-06-29 — — WO disclosed
CN-116283960-A Substituted condensed heterocyclic compound, preparation method and application thereof 上海安诺达生物科技有限公司 2023-06-23 — — CN 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-12435095-B2 Substituted morpholines as ATR kinase inhibitors ATR, WEE1, WEE2 MTOR 122/4885ATR 1/4885ATRIP 7/4885
US-20250051362-A1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF WEE1, ATR, WEE2 MTOR 49/4885ATR 2/4885ATRIP 9/4885

“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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