SCHEMBL30955772

SCHEMBL30955772

CC(C)(C)OC(=O)N1CC[C@H](n2cc([N+](=O)[O-])cn2)[C@H](F)C1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
GPR119 Q8TDV5 7/20 0.39
HPGD P15428 1/20 0.38
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
USP30 Q70CQ3 2/20 0.37
JAK2 O60674 4/20 0.37
JAK1 P23458 4/20 0.37
NR1D1 P20393 1/20 0.37
RECQL P46063 1/20 0.37

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
SCHEMBL30955736 1.00 ALDH1A1 (0.43) ALDH1A1LMNAMAPTGPR119HPGD
SCHEMBL29107817 1.00 ALDH1A1 (0.43) ALDH1A1LMNAMAPTGPR119HPGD
SCHEMBL16985361 1.00 ALDH1A1 (0.43) ALDH1A1LMNAMAPTGPR119HPGD
SCHEMBL16794076 1.00 ALDH1A1 (0.43) ALDH1A1LMNAMAPTGPR119HPGD
SCHEMBL16985425 1.00 ALDH1A1 (0.43) ALDH1A1LMNAMAPTGPR119HPGD
SCHEMBL26341561 0.90 ALDH1A1 (0.45) ALDH1A1LMNAMAPTGPR119HPGD
SCHEMBL16985405 0.89 ALDH1A1 (0.44) ALDH1A1LMNAMAPTGPR119HPGD
SCHEMBL15192197 0.87 ALDH1A1 (0.46) ALDH1A1LMNAMAPTGPR119DDB1
SCHEMBL18383140 0.87 ALDH1A1 (0.46) ALDH1A1LMNAMAPTGPR119DDB1
SCHEMBL16794183 0.87 ALDH1A1 (0.46) ALDH1A1LMNAMAPTGPR119DDB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4638454-A1 SUBSTITUTED IMIDAZO-BASED COMPOUNDS AS LIGAND DIRECTED DEGRADERS OF IRAK3 Celgene Corporation (US) 2025-10-29 EP disclosed
WO-2024137743-A1 SUBSTITUTED IMIDAZO-BASED COMPOUNDS AS LIGAND DIRECTED DEGRADERS OF IRAK3 CELGENE CORPORATION (US) 2024-06-27 WO disclosed