SCHEMBL10990642

SCHEMBL10990642

N#CC(=CNc1nc(-c2ccccc2)cs1)c1nnn[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ HTT P42858 2/20 0.43
▸ KMT2A Q03164 6/20 0.42
▸ MEN1 O00255 5/20 0.41
▸ GFER P55789 2/20 0.41
▸ GSTO1 P78417 1/20 0.41
▸ TP53 P04637 2/20 0.41
▸ LMNA P02545 3/20 0.40
▸ GAA P10253 3/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ ALOX5 P09917 1/20 0.40
▸ AMY1A P0DUB6 1/20 0.40
▸ VCP P55072 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.39
▸ PARP1 P09874 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL10990634 1.00 MAPT (0.46) MAPTSMN1; SMN2HTTKMT2AMEN1
SCHEMBL10985936 0.82 MAPT (0.53) MAPTSMN1; SMN2HTTKMT2AMEN1
SCHEMBL10996793 0.80 MAPT (0.33) MAPTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL10987773 0.77 MEN1 (0.41) MAPTSMN1; SMN2KMT2AMEN1TP53
SCHEMBL9829808 0.75 RAB9A (0.58) MAPTHTTKMT2AMEN1GSTO1
SCHEMBL9832583 0.74 LMNA (0.57) MAPTSMN1; SMN2HTTKMT2AMEN1
SCHEMBL4318524 0.72 GAA (0.43) MAPTSMN1; SMN2HTTKMT2AMEN1
SCHEMBL9595515 0.70 MAPT (0.48) MAPTSMN1; SMN2KMT2AMEN1TP53
SCHEMBL11034895 0.70 MAPT (0.50) MAPTSMN1; SMN2HTTKMT2AMEN1
SCHEMBL10993495 0.70 GAA (0.32) MAPTKMT2AMEN1LMNAGAA

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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