SCHEMBL29284652

SCHEMBL29284652

CSC(C)C(C)n1ncc(C(=S)Nc2ccnnc2)c1C

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PSMB5 P28074 3/20 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
SCHEMBL29284674 0.86 NAMPT (0.40) NPC1HPGDRAB9APSMB5
SCHEMBL29284680 0.76
SCHEMBL29284681 0.75
SCHEMBL29284665 0.75
SCHEMBL30880982 0.74 NAMPT (0.43) NPC1HPGDRAB9APSMB5
SCHEMBL29284677 0.72 KMT2A (0.37) NPC1RAB9AMEN1KMT2A
SCHEMBL29284654 0.71
SCHEMBL15472433 0.71 NAMPT (0.44) NPC1HPGDRAB9APSMB5
SCHEMBL29284673 0.69 KDM4E (0.38) KMT2A
Hydrochloric Acid SCHEMBL29284675 0.68 KDM4E (0.37) KMT2A

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
CN-118206533-A N-pyridazine pyrazole amide compounds 湖南化工研究院有限公司 2024-06-18 CN claimed
CN-118206533-A N-pyridazine pyrazole amide compounds 湖南化工研究院有限公司 2024-06-18 CN disclosed