SCHEMBL6970939

SCHEMBL6970939

COc1ccc2c(c1)c(OCCOc1c(F)cc(F)cc1Br)nn2CCOc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 14/20 0.47
CNR1 P21554 9/20 0.47
ACHE P22303 7/20 0.47
BCHE P06276 2/20 0.36
PIK3R1 P27986 1/20 0.36
PIK3CA P42336 1/20 0.36
PKM P14618 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL6975193 0.90 CNR2 (0.51) CNR2CNR1ACHEBCHEPIK3R1
SCHEMBL6971235 0.85 CNR2 (0.47) CNR2CNR1ACHEBCHEPIK3R1
SCHEMBL6970142 0.82 CNR2 (0.54) CNR2CNR1ACHEBCHEPIK3R1
SCHEMBL6969602 0.79 CNR2 (0.52) CNR2CNR1ACHEPIK3R1PIK3CA
SCHEMBL6969861 0.79 CNR2 (0.44) CNR2CNR1ACHEPIK3R1PIK3CA
SCHEMBL6967696 0.78 ACHE (0.44) CNR2CNR1ACHEALDH1A1MAPT
SCHEMBL6970884 0.76 CNR2 (0.54) CNR2CNR1ACHEBCHEPIK3R1
SCHEMBL6975124 0.76 HTR6 (0.39) ALDH1A1LMNAMAPT
SCHEMBL6973555 0.76 ACHE (0.48) CNR2CNR1ACHEBCHEPIK3R1
SCHEMBL6969154 0.75 CNR2 (0.54) CNR2CNR1ACHEBCHEPIK3R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077947-B1 NOVEL 1,5 AND 3-O-SUBSTITUTED 1H-INDAZOLES WITH ANTI-ASTHMATIC, ANTI-ALLERGIC, ANTI-INFLAMMATORY, IMMUNO-MODULATING AND NEURO-PROTECTIVE EFFECT, METHOD FOR THE PRODUCTION AND USE THEREOF AS MEDICAMENTS DRESDEN ARZNEIMITTEL (DE) 2003-09-03 EP claimed
US-6166023-A 1,5- and 3-O-substituted 1H-indazoles having anti-asthmatic, anti-allergic, anti-inflammatory, immunomodulating and neuroprotective action, process for their preparation and their use as medicaments ARZNEIMITTELWERK DRESDEN GMBH (DE) 2000-12-26 US claimed
EP-1077947-B1 NOVEL 1,5 AND 3-O-SUBSTITUTED 1H-INDAZOLES WITH ANTI-ASTHMATIC, ANTI-ALLERGIC, ANTI-INFLAMMATORY, IMMUNO-MODULATING AND NEURO-PROTECTIVE EFFECT, METHOD FOR THE PRODUCTION AND USE THEREOF AS MEDICAMENTS DRESDEN ARZNEIMITTEL (DE) 2003-09-03 EP disclosed
US-6166023-A 1,5- and 3-O-substituted 1H-indazoles having anti-asthmatic, anti-allergic, anti-inflammatory, immunomodulating and neuroprotective action, process for their preparation and their use as medicaments ARZNEIMITTELWERK DRESDEN GMBH (DE) 2000-12-26 US disclosed