SCHEMBL3356604

SCHEMBL3356604

CN1CCC(n2ncc3ccc([N+](=O)[O-])cc32)CC1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.52
HTR1B P28222 1/20 0.52
HTR1F P30939 1/20 0.52
HTR7 P34969 1/20 0.43
SCD O00767 2/20 0.42
ACHE P22303 1/20 0.42
GLS O94925 1/20 0.41
HRH4 Q9H3N8 3/20 0.41
HRH3 Q9Y5N1 1/20 0.41
ALOX15 P16050 1/20 0.41
PKM P14618 1/20 0.41
MAPT P10636 1/20 0.40
SIRT6 Q8N6T7 1/20 0.40
PRMT5 O14744 1/20 0.40
HIF1A Q16665 1/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL29377201 0.90 GLS (0.50) HTR1AHTR1BHTR1FHTR7SCD
SCHEMBL3355202 0.90 GLS (0.50) HTR1AHTR1BHTR1FHTR7SCD
SCHEMBL3388874 0.90 GLS (0.44) HTR1AHTR1BHTR1FGLSALOX15
SCHEMBL29741245 0.90 GLS (0.44) HTR1AHTR1BHTR1FGLSALOX15
SCHEMBL3349251 0.87 LMNA (0.44) HTR1AHTR1BHTR1FHTR7SCD
SCHEMBL30778513 0.87 MAPT (0.46) HTR1AHTR1BHTR1FGLSALOX15
SCHEMBL3357810 0.87 ALDH1A1 (0.40) HTR1AHTR1BHTR1FSCDGLS
SCHEMBL3352833 0.87 MAPT (0.45) HTR1AHTR1BHTR1FHTR7ACHE
SCHEMBL3353374 0.85 ALDH1A1 (0.48) HTR1AHTR1BHTR1FGLSMAPT
SCHEMBL1868072 0.84 L3MBTL1 (0.43) HTR1AHTR1BHTR1FGLSNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2141163-A1 Substituted thiazolidinones, their production and utilisation as medicine Bayer Schering Pharma AG (DE) 2010-01-06 EP disclosed
CN-1510034-A Indazole compound, preparing method thereof and medicine composition containing the same ɪά��ʵ���� 2004-07-07 CN disclosed
EP-0902027-B1 Indole and indazole derivatives, process for their preparation and the pharmaceutical compositions containing them ADIR (FR) 2001-07-25 EP disclosed
US-6046205-A FOR TREATMENT OF VENOUS INSUFFICIENCY AND OF ASSOCIATED DISORDERS, AND ALSO IN THE TREATMENT OF MIGRAINE ADIR ET COMPAGNIE (FR) 2000-04-04 US disclosed
US-6020336-A Indole and indazole compounds LES LABORATOIRES SERVIER (FR) 2000-02-01 US disclosed
EP-0902027-A1 Indole and indazole derivatives, process for their preparation and the pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-03-17 EP disclosed