SCHEMBL29519306

SCHEMBL29519306

Cn1c2ccccc2c(=O)c2cc([N+](=O)[O-])ccc21

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.80
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
LMNA P02545 3/20 0.57
ATM Q13315 2/20 0.55
POLB P06746 1/20 0.55
P2RX4 Q99571 1/20 0.54
CTSV O60911 1/20 0.52
CTSL P07711 1/20 0.52
F2RL3 Q96RI0 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
F2R P25116 1/20 0.52
ALDH1A1 P00352 2/20 0.52
L3MBTL1 Q9Y468 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
CYP19A1 P11511 1/20 0.49
HCRTR1 O43613 1/20 0.48
XBP1 P17861 1/20 0.48

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
SCHEMBL22282320 1.00 MAPT (0.80) MAPTMEN1KMT2ALMNAATM
SCHEMBL150552 0.89 MAPT (1.00) MAPTMEN1KMT2ALMNAATM
SCHEMBL30600488 0.84 MAPT (0.83) MAPTMEN1KMT2ALMNAATM
SCHEMBL155568 0.84 MAPT (0.83) MAPTMEN1KMT2ALMNAATM
SCHEMBL18928573 0.83 MAPT (0.82) MAPTMEN1KMT2ALMNAATM
SCHEMBL8091855 0.82 MAPT (0.55) MAPTMEN1KMT2ALMNAATM
SCHEMBL27857917 0.82 MAPT (0.75) MAPTMEN1KMT2ALMNAATM
SCHEMBL22282380 0.80 MAPT (0.56) MAPTMEN1KMT2ALMNAATM
SCHEMBL29361718 0.78 ATM (0.71) MAPTMEN1KMT2AATMPOLB
SCHEMBL85776 0.78 ATM (0.71) MAPTMEN1KMT2AATMPOLB

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
US-12174197-B2 Sulfonated 2(7)-aminoacridone and 1-aminopyrene dyes and their use as fluorescent tags, in particular for carbohydrate analysis MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E. V. (DE) 2024-12-24 US disclosed
US-20220107325-A1 SULFONATED 2(7)-AMINOACRIDONE AND 1-AMINOPYRENE DYES AND THEIR USE AS FLUORESCENT TAGS, IN PARTICULAR FOR CARBOHYDRATE ANALYSIS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E. V. (DE) 2022-04-07 US disclosed