SCHEMBL30622706

SCHEMBL30622706

NC(=O)Oc1nc2c(C(Br)Br)cccc2s1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
PDPK1 O15530 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 2/20 0.32
LIMK1 P53667 1/20 0.32
HTR2C P28335 1/20 0.32
DYRK1A Q13627 2/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
CYP3A4 P08684 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
SLC9A1 P19634 1/20 0.30
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL28398556 1.00 MEN1 (0.33) MEN1KMT2APDPK1SMN1; SMN2MAPT
SCHEMBL28564366 0.81 MAPT (0.39) MEN1KMT2APDPK1SMN1; SMN2MAPT
SCHEMBL30622711 0.78 ALDH1A1 (0.53) MEN1KMT2ASMN1; SMN2MAPTNPC1
SCHEMBL28400513 0.78 ALDH1A1 (0.53) MEN1KMT2ASMN1; SMN2MAPTNPC1
SCHEMBL29099875 0.76 MEN1 (0.34) MEN1KMT2APDPK1SMN1; SMN2MAPT
SCHEMBL30622702 0.76 MEN1 (0.34) MEN1KMT2APDPK1SMN1; SMN2MAPT
SCHEMBL6632291 0.71 CYP1A2 (0.54) MEN1KMT2ASMN1; SMN2MAPTDYRK1A
SCHEMBL28782049 0.70 NPC1 (0.34) MAPTDYRK1ANPC1RAB9AALDH1A1
SCHEMBL21821684 0.70 MAPT (0.50) MEN1KMT2AMAPTDYRK1ANPC1
SCHEMBL28902824 0.69 CLK1 (0.31) SMN1; SMN2DYRK1A

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-116969904-A Compounds useful as autophagy modulators, methods of preparation and uses thereof 微境生物医药科技(上海)有限公司 2023-10-31 CN disclosed
CN-111148740-B Compounds useful as autophagy modulators, methods of preparation and uses thereof 微境生物医药科技(上海)有限公司 2023-08-25 CN disclosed