SCHEMBL6969602

SCHEMBL6969602

COc1ccc2c(c1)c(OCCOc1ccc([N+](=O)[O-])cc1)nn2Cc1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 12/20 0.52
▸ ACHE P22303 7/20 0.52
▸ CNR1 P21554 7/20 0.52
▸ MAPT P10636 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ PIK3R1 P27986 1/20 0.45
▸ PIK3CA P42336 1/20 0.45
▸ KMT2A Q03164 1/20 0.44
▸ SIGMAR1 Q99720 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ GAA P10253 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
SCHEMBL6973326 0.88 CNR2 (0.58) CNR2ACHECNR1MAPTSMN1; SMN2
SCHEMBL6978209 0.86 CNR1 (0.49) CNR2ACHECNR1MAPTKMT2A
SCHEMBL6974448 0.85 CNR1 (0.48) CNR2ACHECNR1KMT2AKDM4E
SCHEMBL6979571 0.83 CNR2 (0.56) CNR2ACHECNR1MAPTSMN1; SMN2
SCHEMBL6970142 0.83 CNR2 (0.54) CNR2ACHECNR1MAPTPIK3R1
SCHEMBL6975193 0.80 CNR2 (0.51) CNR2ACHECNR1MAPTPIK3R1
SCHEMBL8809942 0.79 KDM4E (0.58) CNR2ACHECNR1KDM4E
SCHEMBL6970939 0.79 CNR2 (0.47) CNR2ACHECNR1MAPTPIK3R1
SCHEMBL6969154 0.78 CNR2 (0.54) CNR2ACHECNR1MAPTSMN1; SMN2
SCHEMBL6971235 0.78 CNR2 (0.47) CNR2ACHECNR1MAPTSMN1; 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
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