SCHEMBL29731422

SCHEMBL29731422

COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCNCC1

nearest known ligand 0.98

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.98
ERBB2 P04626 3/20 0.82
CIT O14578 1/20 0.82
GAK O14976 1/20 0.82
EPHB6 O15197 1/20 0.82
ABCC4 O15439 1/20 0.82
DAPK3 O43293 1/20 0.82
RIPK2 O43353 1/20 0.82
NR1I2 O75469 1/20 0.82
RPS6KA4 O75676 1/20 0.82
STK17B O94768 1/20 0.82
STK10 O94804 1/20 0.82
PRKD3 O94806 1/20 0.82
ABCB11 O95342 1/20 0.82
MAP4K4 O95819 1/20 0.82
CHEK2 O96017 1/20 0.82
ABL1 P00519 1/20 0.82
LCK P06239 1/20 0.82
LYN P07948 1/20 0.82
RET P07949 1/20 0.82

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
SCHEMBL4222431 1.00 EGFR (0.98) EGFRERBB2CITGAKEPHB6
SCHEMBL22962690 0.92 EGFR (0.84) EGFRERBB2CITGAKEPHB6
SCHEMBL12012 0.92 EGFR (1.00) EGFRERBB2CITGAKEPHB6
SCHEMBL17520338 0.92 EGFR (1.00) EGFRERBB2CITGAKEPHB6
SCHEMBL22338480 0.92 EGFR (0.92) EGFRERBB2CITGAKEPHB6
SCHEMBL11395 0.92 EGFR (1.00) EGFRERBB2CITGAKEPHB6
SCHEMBL22336591 0.90 EGFR (0.86) EGFRERBB2CITGAKEPHB6
Gefitinib SCHEMBL29351046 0.90 EGFR (1.00) EGFRERBB2CITGAKEPHB6
Gefitinib SCHEMBL29351336 0.90 EGFR (1.00) EGFRERBB2CITGAKEPHB6
Gefitinib SCHEMBL465143 0.90 EGFR (1.00) EGFRERBB2CITGAKEPHB6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119823212-A Tumor targeting self-assembled nano preparation based on protein degradation technology and preparation method and application thereof 铜仁职业技术学院 2025-04-15 CN claimed
EP-4612149-A1 PYRIDO[2,3-D]PYRIMIDIN-2-AMINE DERIVATIVES AS EGFR INHIBITORS FOR THE TREATMENT OF CANCER Cancer Research Technology Limited (GB) 2025-09-10 EP disclosed
EP-4612148-A1 2-AMINO-PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE AND 7-AMINO-1-PYRIMIDO[4,5-D]PYRIMIDIN-2(1 H)-ONE DERIVATIVES AS EGFR INHIBITORS FOR THE TREATMENT OF CANCER Cancer Research Technology Limited (GB) 2025-09-10 EP disclosed
CN-119823212-A Tumor targeting self-assembled nano preparation based on protein degradation technology and preparation method and application thereof 铜仁职业技术学院 2025-04-15 CN disclosed
WO-2024094963-A1 2-AMINO-PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE AND 7-AMINO-1-PYRIMIDO[4,5-D]PYRIMIDIN-2(1 H)-ONE DERIVATIVES AS EGFR INHIBITORS FOR THE TREATMENT OF CANCER CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2024-05-10 WO disclosed
CN-112321566-B EGFR protein degradation agent and anti-tumor application thereof 上海科技大学 2022-06-10 CN disclosed