SCHEMBL28588259

SCHEMBL28588259

CN1C(=O)c2cccc3c(N4CCC4)ccc(c23)C1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 13/20 0.67
KMT2A Q03164 13/20 0.67
L3MBTL1 Q9Y468 3/20 0.67
RAB9A P51151 2/20 0.67
MAPK1 P28482 2/20 0.67
MAPT P10636 4/20 0.63
NPC1 O15118 1/20 0.63
AVPR1A P37288 1/20 0.63
USP2 O75604 6/20 0.58
ALDH1A1 P00352 4/20 0.58
KEAP1 Q14145 3/20 0.58
NFE2L2 Q16236 3/20 0.58
HPGD P15428 2/20 0.58
KDM4E B2RXH2 2/20 0.58
ATM Q13315 1/20 0.58
HTT P42858 4/20 0.58
LMNA P02545 4/20 0.58
TLR9 Q9NR96 2/20 0.58
POLB P06746 2/20 0.58
CRHBP P24387 1/20 0.58

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
SCHEMBL16784368 0.88 MEN1 (0.68) MEN1KMT2AL3MBTL1RAB9AMAPK1
SCHEMBL28413936 0.84 MEN1 (0.59) MEN1KMT2AL3MBTL1RAB9AMAPK1
SCHEMBL17833833 0.84 MEN1 (0.74) MEN1KMT2AL3MBTL1RAB9AMAPK1
SCHEMBL28411756 0.83 MEN1 (0.54) MEN1KMT2AL3MBTL1RAB9AMAPK1
SCHEMBL7709797 0.81 KMT2A (0.67) MEN1KMT2AL3MBTL1RAB9AMAPK1
SCHEMBL28027890 0.81 MEN1 (0.63) MEN1KMT2AL3MBTL1RAB9AMAPK1
SCHEMBL23009270 0.81 MEN1 (0.78) MEN1KMT2AL3MBTL1RAB9AMAPK1
SCHEMBL22049920 0.80 MEN1 (0.49) MEN1KMT2AL3MBTL1RAB9AMAPK1
SCHEMBL28578676 0.80 MEN1 (0.50) MEN1KMT2AL3MBTL1RAB9AMAPK1
SCHEMBL7709609 0.80 KMT2A (0.69) MEN1KMT2AL3MBTL1RAB9AMAPK1

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-112939936-A Carbonyl azetidine substituted naphthalimide fluorescent dye and synthetic method and application thereof 中国科学院大连化学物理研究所 2021-06-11 CN disclosed