SCHEMBL29554156

SCHEMBL29554156

c1ccc(N(c2ccccc2)c2ccc(-c3ccc4c5c(ccc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)c35)-c3nc5ccccc5n3C4)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.51
RAB9A P51151 8/20 0.51
NPC1 O15118 6/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
HSD17B10 Q99714 4/20 0.51
TP53 P04637 3/20 0.51
PKM P14618 2/20 0.51
TSHR P16473 1/20 0.51
ALDH1A1 P00352 9/20 0.38
HPGD P15428 8/20 0.38
MAPT P10636 7/20 0.38
HTT P42858 3/20 0.38
KMT2A Q03164 3/20 0.38
GFER P55789 2/20 0.38
MEN1 O00255 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL19917859 0.77 KDM4E (0.58) KDM4ERAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL29553308 0.76 KDM4E (0.42) KDM4ERAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL5801394 0.69 KDM4E (1.00) KDM4ERAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL17690385 0.68 ESR1 (0.49) KDM4ERAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL15803041 0.67 RECQL (0.45) KDM4ERAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL20954100 0.67 ESR1 (0.44) KDM4ERAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL12114882 0.67 RECQL (0.47) KDM4ERAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL29554009 0.67 MAPT (0.53) KDM4ERAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL15803043 0.67 ESR1 (0.47) KDM4ERAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL13133843 0.66 ESR1 (0.60) KDM4ERAB9ANPC1SMN1; SMN2HSD17B10

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112457313-B Naphthalimide-azacyclo-luminescent material and application thereof 深圳大学 2022-04-08 CN disclosed