SCHEMBL29918706

SCHEMBL29918706

CC(=O)Nc1cccc2cccnc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.71
POLB P06746 2/20 0.71
SLC40A1 Q9NP59 1/20 0.68
KDR P35968 3/20 0.65
MAPT P10636 3/20 0.63
SMN1; SMN2 Q16637 3/20 0.63
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
KDM4E B2RXH2 2/20 0.61
HDAC6 Q9UBN7 1/20 0.61
RECQL P46063 1/20 0.61
CASP3 P42574 1/20 0.61
SENP8 Q96LD8 1/20 0.61
SENP7 Q9BQF6 1/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
HTT P42858 2/20 0.60
GAA P10253 1/20 0.60

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
SCHEMBL5053488 1.00 TDP1 (0.71) TDP1POLBSLC40A1KDRMAPT
SCHEMBL28258549 0.90 TDP1 (0.59) TDP1POLBSLC40A1KDRMAPT
SCHEMBL29851236 0.84 KDR (0.71) TDP1POLBKDRMAPTSMN1; SMN2
SCHEMBL1695444 0.84 KDR (0.71) TDP1POLBKDRMAPTSMN1; SMN2
SCHEMBL13609772 0.84 TDP1 (0.64) TDP1POLBKDRMAPTSMN1; SMN2
SCHEMBL21121176 0.83 POLB (0.68) TDP1POLBKDRMAPTSMN1; SMN2
SCHEMBL3909349 0.83 TDP1 (0.67) TDP1POLBKDRMAPTSMN1; SMN2
SCHEMBL14851783 0.83 TDP1 (0.69) TDP1POLBKDRMAPTSMN1; SMN2
SCHEMBL3549883 0.83 CYP1A2 (0.71) TDP1POLBKDRMAPTSMN1; SMN2
SCHEMBL1753903 0.83 TDP1 (0.79) TDP1POLBKDRMAPTSMN1; 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
CN-115057443-A Silicon electrode material with good cycle stability and preparation method thereof 无锡纳斯凯半导体科技有限公司 2022-09-16 CN claimed
CN-115057443-A Silicon electrode material with good cycle stability and preparation method thereof 无锡纳斯凯半导体科技有限公司 2022-09-16 CN disclosed