SCHEMBL10993495

SCHEMBL10993495

N#CC(=CNc1ccc[nH]1)c1nnn[nH]1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL10993921 0.78 GAA (0.42) GAAMEN1LMNAMAPTKMT2A
SCHEMBL4318524 0.76 GAA (0.43) GAAMEN1LMNAMAPTKMT2A
SCHEMBL4318522 0.76 GAA (0.43) GAAMEN1LMNAMAPTKMT2A
SCHEMBL9599085 0.74 GAA (0.33) GAAMEN1LMNAMAPTKMT2A
SCHEMBL11034895 0.73 MAPT (0.50) GAAMEN1LMNAMAPTKMT2A
SCHEMBL9038730 0.73 MAPT (0.43) GAAMEN1LMNAMAPTKMT2A
SCHEMBL9038722 0.73 MAPT (0.43) GAAMEN1LMNAMAPTKMT2A
SCHEMBL10987783 0.71 MEN1 (0.41) GAAMEN1LMNAMAPTKMT2A
SCHEMBL10987773 0.71 MEN1 (0.41) GAAMEN1LMNAMAPTKMT2A
SCHEMBL9596037 0.71 ALDH1A1 (0.41) MEN1MAPTKMT2A

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
US-4491587-A ANTIALLERGENS, ANTIHISTAMINES, MUSCLE RELAXANTS/ INSULATING POWDER BLANKET ABOVD THE MELT WITH HEAT GENERATED IN THE MELT BY ELECTRIC CURRENT; LOWER TEMPERATURE MEAD JOHNSON & COMPANY (US) 1985-01-01 — — US disclosed
US-4223031-A ANTIALLERGENS, ANTIHISTAMINES, BRONCHODILATOR AGENTS, HYPERSENSITIVITY MEAD JOHNSON & COMPANY (US) 1980-09-16 — — US disclosed
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