SCHEMBL10994816

SCHEMBL10994816

Cc1csc(NC=C(C#N)C#N)n1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ RAB9A P51151 10/20 0.41
▸ NPC1 O15118 8/20 0.41
▸ FDPS P14324 1/20 0.41
▸ GAA P10253 6/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ HPGD P15428 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ TP53 P04637 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ RCE1 Q9Y256 1/20 0.37
▸ L3MBTL1 Q9Y468 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
SCHEMBL10991118 0.79 MAPT (0.33) MAPTHSD17B10RAB9ANPC1FDPS
SCHEMBL10996793 0.79 MAPT (0.33) MAPTHSD17B10RAB9ANPC1FDPS
SCHEMBL10985936 0.73 MAPT (0.53) MAPTHSD17B10RAB9ANPC1GAA
SCHEMBL21354116 0.70 RAB9A (0.44) MAPTHSD17B10RAB9ANPC1FDPS
SCHEMBL10531759 0.69 — —
SCHEMBL10994240 0.68 MAPT (0.45) MAPTHSD17B10RAB9ANPC1FDPS
SCHEMBL6374526 0.68 MAPT (0.53) MAPTHSD17B10RAB9ANPC1GAA
SCHEMBL20187610 0.67 MAPT (0.41) MAPTRAB9ANPC1FDPSGAA
SCHEMBL20187609 0.67 MAPT (0.41) MAPTRAB9ANPC1FDPSGAA
SCHEMBL10992289 0.67 GAA (0.45) MAPTRAB9ANPC1GAASMN1; SMN2

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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