SCHEMBL18928573

SCHEMBL18928573

Cn1c2ccccc2c2ccc([N+](=O)[O-])cc21

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.82
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
GPR3 P46089 1/20 0.53
F2RL3 Q96RI0 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
F2R P25116 1/20 0.49
CYP19A1 P11511 1/20 0.49
KIF11 P52732 1/20 0.49
ALDH1A1 P00352 2/20 0.48
NPC1 O15118 1/20 0.48
XBP1 P17861 1/20 0.48
RAB9A P51151 1/20 0.48
PAX8 Q06710 1/20 0.48
TLR9 Q9NR96 1/20 0.48
KDM4E B2RXH2 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
SCHEMBL7708920 0.91 MAPT (0.67) MAPTMEN1KMT2ALMNAATM
SCHEMBL150552 0.90 MAPT (1.00) MAPTMEN1KMT2ALMNAATM
SCHEMBL22282320 0.83 MAPT (0.80) MAPTMEN1KMT2ALMNAATM
SCHEMBL29519306 0.83 MAPT (0.80) MAPTMEN1KMT2ALMNAATM
SCHEMBL30600488 0.80 MAPT (0.83) MAPTMEN1KMT2ALMNAATM
SCHEMBL155568 0.80 MAPT (0.83) MAPTMEN1KMT2ALMNAATM
SCHEMBL7979640 0.80 MAPT (0.83) MAPTMEN1KMT2ALMNAATM
Nitric Acid SCHEMBL31591113 0.78 GPR3 (0.67) MAPTMEN1KMT2ALMNAATM
SCHEMBL28297109 0.78 MAPT (0.59) MAPTMEN1KMT2ALMNAATM
Hydrochloric Acid SCHEMBL28297111 0.77 MAPT (0.58) MAPTMEN1KMT2ALMNAATM

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-109851550-A 7- aminocarbazole sulfamide derivative and its preparation method and application 中国医学科学院医药生物技术研究所 2019-06-07 CN disclosed
WO-2017093718-A1 1-CYANO-PYRROLIDINE DERIVATIVES AS INHIBITORS OF USP30. MISSION THERAPEUTICS LIMITED (GB) 2017-06-08 WO disclosed