SCHEMBL6965786

SCHEMBL6965786

COc1ccc2c(c1)c(OCc1cc3c(cc1Cl)OCO3)nn2Cc1cccc([N+](=O)[O-])c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 14/20 0.54
CNR1 P21554 9/20 0.54
ACHE P22303 6/20 0.54
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MCHR1 Q99705 1/20 0.43
LMNA P02545 1/20 0.43
BCHE P06276 2/20 0.42
PIK3R1 P27986 1/20 0.42
PIK3CA P42336 1/20 0.42
PLA2G2A P14555 1/20 0.41

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
SCHEMBL6966956 0.87 CNR2 (0.42) CNR2CNR1ACHEMAPTSMN1; SMN2
SCHEMBL6968297 0.87 CNR2 (0.49) CNR2CNR1ACHEMCHR1BCHE
SCHEMBL6967955 0.85 CNR2 (0.61) CNR2CNR1ACHEMAPTSMN1; SMN2
SCHEMBL6975318 0.83 CNR1 (0.48) CNR2CNR1ACHEMCHR1
SCHEMBL6969393 0.81 CNR2 (0.64) CNR2CNR1ACHEMAPTSMN1; SMN2
SCHEMBL6979571 0.80 CNR2 (0.56) CNR2CNR1ACHEMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL6971824 0.80 CNR2 (0.63) CNR2CNR1ACHEMAPTSMN1; SMN2
SCHEMBL6973326 0.79 CNR2 (0.58) CNR2CNR1ACHEMAPTSMN1; SMN2
SCHEMBL6969154 0.77 CNR2 (0.54) CNR2CNR1ACHEMAPTSMN1; SMN2
SCHEMBL6965790 0.76 CNR2 (0.44) CNR2CNR1ACHEMAPTSMN1; SMN2

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