SCHEMBL30982267

SCHEMBL30982267

CNC(=O)c1ccc(N2CCN(C(=O)OC(C)(C)C)CC2)c(C(F)F)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 2/20 0.48
▸ PARP1 P09874 2/20 0.47
▸ PARP6 Q2NL67 2/20 0.47
▸ PARP2 Q9UGN5 2/20 0.47
▸ PARP3 Q9Y6F1 2/20 0.47
▸ TNKS O95271 1/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.45
▸ MAPT P10636 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ TSHR P16473 1/20 0.45
▸ LMNA P02545 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ ACHE P22303 2/20 0.42
▸ CYP2C19 P33261 1/20 0.41
▸ CKS1B P61024 1/20 0.41
▸ SKP1 P63208 1/20 0.41
▸ SKP2 Q13309 1/20 0.41
▸ PTPN11 Q06124 1/20 0.41
▸ HTT P42858 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
SCHEMBL22912769 1.00 BACE1 (0.48) BACE1PARP1PARP6PARP2PARP3
SCHEMBL30480785 0.92 BACE1 (0.43) BACE1PARP1PARP6PARP2PARP3
SCHEMBL25286476 0.92 BACE1 (0.43) BACE1PARP1PARP6PARP2PARP3
SCHEMBL22912768 0.85 BACE1 (0.53) BACE1PARP1PARP6PARP2PARP3
SCHEMBL29790202 0.85 BACE1 (0.53) BACE1PARP1PARP6PARP2PARP3
SCHEMBL30212738 0.85 PARP1 (0.51) PARP1PARP6PARP2PARP3TNKS
SCHEMBL22912731 0.84 BACE1 (0.52) BACE1PARP1PARP6PARP2PARP3
SCHEMBL30212537 0.84 BACE1 (0.52) BACE1PARP1PARP6PARP2PARP3
SCHEMBL22912788 0.83 BACE1 (0.49) BACE1PARP1PARP6PARP2PARP3
SCHEMBL31042187 0.83 BACE1 (0.49) BACE1PARP1PARP6PARP2PARP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122059929-A Quinoxaline derivatives as anticancer agents 阿斯利康(瑞典)有限公司 2026-05-19 — — CN disclosed
CN-122036687-A Quinoxaline derivatives as anticancer agents 阿斯利康(瑞典)有限公司 2026-05-15 — — CN disclosed
CN-122036686-A Quinoxaline derivatives as anticancer agents 阿斯利康(瑞典)有限公司 2026-05-15 — — CN disclosed
CN-122010903-A Quinoxaline derivatives as anticancer agents 阿斯利康(瑞典)有限公司 2026-05-12 — — CN disclosed
CN-118317793-A Methods for treating brain tumors and neuroblastomas 阿斯利康(瑞典)有限公司 2024-07-09 — — CN disclosed
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