SCHEMBL10991118

SCHEMBL10991118

Cc1csc(NC=C(C#N)c2nnn[nH]2)n1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ FDPS P14324 1/20 0.33
▸ RAB9A P51151 8/20 0.32
▸ SMN1; SMN2 Q16637 5/20 0.32
▸ NPC1 O15118 5/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ STAT6 P42226 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ GAA P10253 4/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ GLA P06280 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ GRM5 P41594 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31

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
SCHEMBL10996793 1.00 MAPT (0.33) MAPTHSD17B10FDPSRAB9ASMN1; SMN2
SCHEMBL10994816 0.79 MAPT (0.42) MAPTHSD17B10FDPSRAB9ASMN1; SMN2
SCHEMBL10987783 0.72 MEN1 (0.41) MAPTHSD17B10RAB9ASMN1; SMN2NPC1
SCHEMBL10990825 0.70 TSHR (0.37) MAPTHSD17B10RAB9ASMN1; SMN2NPC1
SCHEMBL9038730 0.69 MAPT (0.43) MAPTFDPSRAB9ASMN1; SMN2NPC1
SCHEMBL9038722 0.69 MAPT (0.43) MAPTFDPSRAB9ASMN1; SMN2NPC1
SCHEMBL4318522 0.67 GAA (0.43) MAPTHSD17B10RAB9ASMN1; SMN2NPC1
SCHEMBL4318524 0.67 GAA (0.43) MAPTHSD17B10RAB9ASMN1; SMN2NPC1
SCHEMBL9599085 0.65 GAA (0.33) MAPTRAB9ANPC1KMT2AMEN1
SCHEMBL15660784 0.62 HSD17B10 (0.51) MAPTHSD17B10SMN1; SMN2KMT2AMEN1

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
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 claimed
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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