SCHEMBL7979640

SCHEMBL7979640

CCn1c2ccccc2c2ccc([N+](=O)[O-])cc21

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.83
KMT2A Q03164 7/20 0.83
MEN1 O00255 5/20 0.83
LMNA P02545 2/20 0.83
NQO2 P16083 1/20 0.60
POLB P06746 1/20 0.58
ATM Q13315 1/20 0.58
CYP1A2 P05177 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.56
PDE4A P27815 1/20 0.53
PDE4B Q07343 1/20 0.53
PDE4C Q08493 1/20 0.53
PDE4D Q08499 1/20 0.53
ALDH1A1 P00352 3/20 0.51
HTT P42858 2/20 0.51
NPC1 O15118 1/20 0.51
MITF O75030 1/20 0.51
AGTR1 P30556 1/20 0.51
RAB9A P51151 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL29666347 0.91 MAPT (1.00) MAPTKMT2AMEN1LMNANQO2
SCHEMBL149167 0.91 MAPT (1.00) MAPTKMT2AMEN1LMNANQO2
SCHEMBL27936304 0.91 MAPT (0.82) MAPTKMT2AMEN1LMNANQO2
SCHEMBL28710625 0.89 MAPT (0.81) MAPTKMT2AMEN1LMNANQO2
SCHEMBL29767664 0.89 MAPT (0.81) MAPTKMT2AMEN1LMNANQO2
SCHEMBL16229055 0.89 MAPT (0.80) MAPTKMT2AMEN1LMNANQO2
SCHEMBL6170278 0.86 MAPT (0.75) MAPTKMT2AMEN1LMNANQO2
SCHEMBL6171044 0.86 KMT2A (0.75) MAPTKMT2AMEN1LMNANQO2
SCHEMBL16229056 0.86 MAPT (0.89) MAPTKMT2AMEN1LMNANQO2
SCHEMBL148001 0.82 MAPT (0.85) MAPTKMT2AMEN1LMNANQO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113941303-B Nitration system, synthesis system and method for continuously synthesizing permanent violet 安徽申兰华色材有限公司 2022-07-12 CN disclosed
CN-113941303-A Nitration system, synthesis system and method for continuously synthesizing permanent violet 安徽申兰华色材有限公司 2022-01-18 CN disclosed
WO-2001007409-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA UK LIMITED (GB) 2001-02-01 WO disclosed