SCHEMBL6682991

SCHEMBL6682991

N#Cc1ccccc1/C=C/[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.54
NPSR1 Q6W5P4 6/20 0.54
ALDH1A1 P00352 5/20 0.54
LMNA P02545 4/20 0.54
HPGD P15428 4/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
MAPK1 P28482 4/20 0.54
HTT P42858 2/20 0.54
PKM P14618 1/20 0.54
GPR55 Q9Y2T6 1/20 0.54
RXRA P19793 1/20 0.53
FBP1 P09467 7/20 0.50
TLR4 O00206 2/20 0.49
TLR2 O60603 2/20 0.49
PRMT1 Q99873 1/20 0.44
HSP90AA1 P07900 3/20 0.41
CCR6 P51684 2/20 0.40
MEN1 O00255 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2D6 P10635 2/20 0.40

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
SCHEMBL6682996 1.00 MAPT (0.54) MAPTNPSR1ALDH1A1LMNAHPGD
SCHEMBL28648605 0.79 RXRA (0.50) MAPTNPSR1ALDH1A1LMNAHPGD
SCHEMBL29732385 0.78 TSHR (0.48) ALDH1A1LMNAHPGDSMN1; SMN2HTT
SCHEMBL1932223 0.78 TSHR (0.48) ALDH1A1LMNAHPGDSMN1; SMN2HTT
SCHEMBL7905215 0.78 TSHR (0.48) ALDH1A1LMNAHPGDSMN1; SMN2HTT
SCHEMBL9187108 0.76 TSHR (0.46) ALDH1A1LMNAHPGDSMN1; SMN2HTT
SCHEMBL9814799 0.76 SNCA (0.50) MAPTSMN1; SMN2MAPK1HTTFBP1
SCHEMBL9814803 0.76 SNCA (0.50) MAPTSMN1; SMN2MAPK1HTTFBP1
SCHEMBL2541206 0.75 MAPT (0.48) MAPTNPSR1ALDH1A1LMNAHPGD
SCHEMBL2541208 0.75 MAPT (0.48) MAPTNPSR1ALDH1A1LMNAHPGD

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-106117113-B Polysubstituted carbazole, derivative and its synthetic method 湘潭大学 2019-08-16 CN disclosed
WO-2004030637-A2 TREATMENT OF OBESITY AND OTHER DISORDERS ASSOCIATED WITH EXCESSIVE FOOD INTAKE MERCK & CO., INC. (US) 2004-04-15 WO disclosed