SCHEMBL23780741

SCHEMBL23780741

Fc1cc(I)c2cn[nH]c2n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 2/20 0.36
▸ HTR2C P28335 5/20 0.36
▸ HTR2A P28223 5/20 0.35
▸ XDH P47989 2/20 0.33
▸ RET P07949 1/20 0.33
▸ PI4KA P42356 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ PI4K2B Q8TCG2 1/20 0.33
▸ PI4K2A Q9BTU6 1/20 0.33
▸ PI4KB Q9UBF8 1/20 0.33
▸ CCNA2 P20248 2/20 0.32
▸ CDK2 P24941 2/20 0.32
▸ EGFR P00533 1/20 0.32
▸ PLK4 O00444 2/20 0.32
▸ PAK4 O96013 2/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ MKNK1 Q9BUB5 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ ALDH1A1 P00352 2/20 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
SCHEMBL29442177 1.00 NOS1 (0.36) NOS1HTR2CHTR2AXDHRET
SCHEMBL24348557 0.77 PLK4 (0.38) NOS1HTR2CHTR2AXDHRET
SCHEMBL22554143 0.77 PLK4 (0.41) NOS1XDHRETPI4KALRRK2
SCHEMBL24348567 0.72 JAK2 (0.36) NOS1HTR2ACDK2MAPK1ALDH1A1
SCHEMBL24809820 0.69 DYRK1A (0.37) RETLRRK2PAK4MAPK1ADORA2A
SCHEMBL30406140 0.67 HTR2C (0.37) HTR2CHTR2AXDHRETPI4KA
SCHEMBL24348566 0.67 HTR2C (0.37) HTR2CHTR2AXDHRETPI4KA
SCHEMBL20093432 0.64 HTR2C (0.41) HTR2CHTR2AXDHCCNA2CDK2
SCHEMBL290117 0.64 NOS1 (0.47) NOS1XDHRETPI4KALRRK2
SCHEMBL13692758 0.64 NOS1 (0.52) NOS1CDK2MAPK1HTTMKNK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260078119-A1 DEGRADER COMPOUNDS AND USES THEREOF BRISTOL MYERS SQUIBB CO (US) 2026-03-19 — — US disclosed
EP-4688771-A1 NOVEL FAK DEGRADER COMPOUNDS AND USES THEREOF Bristol-Myers Squibb Company (US) 2026-02-11 — — EP disclosed
US-20250179070-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF PREPARING COMPOUNDS AND OF THEIR USE AS ATR KINASE INHIBITORS REPARE THERAPEUTICS INC (CA) 2025-06-05 — — US disclosed
US-12264155-B2 Compounds, pharmaceutical compositions, and methods of preparing compounds and of their use as ATR kinase inhibitors REPARE THERAPEUTICS INC. (CA) 2025-04-01 — — US disclosed
CN-114174292-B Substituted 2-morpholinopyridine derivatives as ATR kinase inhibitors 修复治疗公司 2024-06-18 — — CN disclosed
US-20220185809-A1 SUBSTITUTED 2-MORPHOLINOPYRIDINE DERIVATIVES AS ATR KINASE INHIBITORS REPARE THERAPEUTICS INC. (CA) 2022-06-16 — — US disclosed
CN-114174292-A Substituted 2-morpholinopyridine derivatives as ATR kinase inhibitors 修复治疗公司 2022-03-11 — — CN disclosed
CN-113454080-A Compounds, pharmaceutical compositions and methods of making compounds and methods of use thereof 修复治疗公司 2021-09-28 — — CN disclosed
US-20210277002-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF PREPARING COMPOUNDS AND OF THEIR USE AS ATR KINASE INHIBITORS REPARE THERAPEUTICS INC. (CA) 2021-09-09 — — 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 (5 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-20260078119-A1 DEGRADER COMPOUNDS AND USES THEREOF CTTN, SRC, PTK2 NOS1 4286/4885HTR2C 1652/4885HTR2A 1542/4885
US-20250179070-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF PREPARING COMPOUNDS AND OF THEIR USE AS ATR KINASE INHIBITORS ATR, CHEK2, CHEK1 NOS1 4066/4885HTR2C 4048/4885HTR2A 3936/4885
US-20220185809-A1 SUBSTITUTED 2-MORPHOLINOPYRIDINE DERIVATIVES AS ATR KINASE INHIBITORS ATR, CHEK2, CHEK1 NOS1 3866/4885HTR2C 3700/4885HTR2A 3436/4885
US-12264155-B2 Compounds, pharmaceutical compositions, and methods of preparing compounds and of their use as ATR kinase inhibitors ATR, CHEK2, CHEK1 NOS1 4066/4885HTR2C 4048/4885HTR2A 3936/4885
US-20210277002-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF PREPARING COMPOUNDS AND OF THEIR USE AS ATR KINASE INHIBITORS ATR, CHEK2, CHEK1 NOS1 4066/4885HTR2C 4048/4885HTR2A 3936/4885

“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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