SCHEMBL29529581

SCHEMBL29529581

CC(C)(C)OC(=O)N1CCC[C@H]1COc1cnccc1Br

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.47
FEN1 P39748 1/20 0.47
CHRNB2 P17787 1/20 0.47
CHRNA4 P43681 1/20 0.47
CHRNB4 P30926 1/20 0.46
CHRNA3 P32297 1/20 0.46
UCHL1 P09936 1/20 0.44
F2RL3 Q96RI0 4/20 0.43
FPR3 P25089 1/20 0.43
FPR2 P25090 1/20 0.43
GPR119 Q8TDV5 5/20 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
SCHEMBL23579441 1.00 ALOX5AP (0.47) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL30743365 1.00 ALOX5AP (0.47) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL26783267 1.00 ALOX5AP (0.47) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL29529911 0.94 GPR119 (0.43) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL24399166 0.94 GPR119 (0.43) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL23605880 0.94 GPR119 (0.43) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL29508261 0.94 GPR119 (0.43) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL22602644 0.86 ALOX5AP (0.48) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL22602678 0.86 ALOX5AP (0.48) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL29102386 0.86 ALOX5AP (0.48) ALOX5APFEN1CHRNB2CHRNA4CHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4565584-A1 1H-PYRROLO[3,2-B]PYRIDINE DERIVATIVES AS IRREVERSIBLE INHIBITORS OF MUTANT EGFR FOR THE TREATMENT OF CANCER Bayer Aktiengesellschaft (DE) 2025-06-11 EP disclosed
WO-2024028316-A1 1H-PYRROLO[3,2-B]PYRIDINE DERIVATIVES AS IRREVERSIBLE INHIBITORS OF MUTANT EGFR FOR THE TREATMENT OF CANCER BAYER AKTIENGESELLSCHAFT (DE) 2024-02-08 WO disclosed
EP-4217070-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER Scorpion Therapeutics, Inc. (US) 2023-08-02 EP disclosed
WO-2022066734-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER SCORPION THERAPEUTICS, INC. (US) 2022-03-31 WO disclosed