SCHEMBL10987783

SCHEMBL10987783

N#CC(=CNc1nc2ccccc2s1)c1nnn[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.41
▸ KMT2A Q03164 8/20 0.41
▸ MAPT P10636 7/20 0.41
▸ RAB9A P51151 5/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ LMNA P02545 3/20 0.41
▸ RECQL P46063 3/20 0.41
▸ HPGD P15428 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ NFKB2 Q00653 1/20 0.41
▸ RELA Q04206 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ BRCA1 P38398 1/20 0.40
▸ HBB P68871 1/20 0.40
▸ IDO1 P14902 1/20 0.40
▸ GAA P10253 2/20 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
SCHEMBL10987773 1.00 MEN1 (0.41) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL10991481 0.82 NPC1 (0.47) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL10995032 0.82 NPC1 (0.47) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL10995025 0.82 NPC1 (0.47) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL10991472 0.82 NPC1 (0.47) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL10990696 0.81 IDO1 (0.51) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL10988567 0.80 DYRK1A (0.48) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL10988561 0.80 DYRK1A (0.48) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL10990642 0.77 MAPT (0.46) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL10990634 0.77 MAPT (0.46) MEN1KMT2AMAPTRAB9ASMN1; 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 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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