SCHEMBL30441586

SCHEMBL30441586

CC(=O)Nc1cc(O)ccn1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.57
PIK3C3 Q8NEB9 14/20 0.51
JAK2 O60674 1/20 0.50
JAK1 P23458 1/20 0.50
TYK2 P29597 1/20 0.50
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
MAPKAPK2 P49137 1/20 0.46
ACVRL1 P37023 1/20 0.45

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
SCHEMBL19736191 1.00 L3MBTL1 (0.57) L3MBTL1PIK3C3JAK2JAK1TYK2
SCHEMBL11964359 0.82 NPC1 (0.43) L3MBTL1PIK3C3JAK2JAK1TYK2
SCHEMBL25600283 0.81 JAK2 (0.52) PIK3C3JAK2JAK1TYK2ALDH1A1
SCHEMBL2642300 0.81 L3MBTL1 (0.57) L3MBTL1PIK3C3JAK2JAK1TYK2
SCHEMBL13165570 0.81 TYK2 (0.66) L3MBTL1PIK3C3JAK2JAK1TYK2
SCHEMBL91475 0.81 ALDH1A1 (0.60) L3MBTL1PIK3C3ALDH1A1CYP1A2
SCHEMBL19728666 0.80 TYK2 (0.53) TYK2ALDH1A1ACVRL1
SCHEMBL18785787 0.80 LMNA (0.53) L3MBTL1CYP1A2
SCHEMBL16311114 0.80 JAK2 (0.53) L3MBTL1JAK2JAK1TYK2ALDH1A1
SCHEMBL12975420 0.79 L3MBTL1 (0.55) L3MBTL1PIK3C3JAK2JAK1TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4430042-A1 6-HE TERO ARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. (US) 2024-09-18 EP disclosed
CN-118201928-A 6-Heteroaryloxy benzimidazoles and azabenzimidazoles as JAK2 inhibitors 艾捷斯治疗公司 2024-06-14 CN disclosed
WO-2023086319-A1 6-HE TERO ARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. (US) 2023-05-19 WO disclosed