SCHEMBL8825355

SCHEMBL8825355

CCOC(=O)c1noc(-c2ccc([N+](=O)[O-])cc2)n1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.54
GAA P10253 1/20 0.54
HTT P42858 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
MAPT P10636 5/20 0.50
AR P10275 3/20 0.50
LMNA P02545 1/20 0.49
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 1/20 0.49
KMT2A Q03164 1/20 0.49
PRKCZ Q05513 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
CHRNB2 P17787 1/20 0.45
CHRNA5 P30532 1/20 0.45
CHRNA4 P43681 1/20 0.45
GABRA2 P47869 1/20 0.44
GABRB2 P47870 1/20 0.44

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
SCHEMBL8825286 0.87 ALDH1A1 (0.61) RAB9AMAPTNPC1ALDH1A1KMT2A
SCHEMBL8341931 0.82 TARBP2 (0.60) RAB9AMAPTLMNANPC1ALDH1A1
SCHEMBL8825390 0.82 ALDH1A1 (0.53) RAB9AGAAHTTL3MBTL1MAPT
SCHEMBL893056 0.81 HDAC1 (0.57) RAB9AGAAMAPTLMNANPC1
SCHEMBL8825172 0.81 ALDH1A1 (0.75) RAB9AGAAHTTL3MBTL1MAPT
SCHEMBL8825404 0.81 ALDH1A1 (0.52) RAB9AHTTMAPTNPC1ALDH1A1
SCHEMBL8825348 0.81 L3MBTL1 (0.58) RAB9AGAAHTTL3MBTL1MAPT
SCHEMBL8825537 0.80 CDC7 (0.51) RAB9AGAAMAPTLMNANPC1
SCHEMBL8825115 0.80 ALDH1A1 (0.51) HTTMAPTLMNAALDH1A1KMT2A
SCHEMBL8825164 0.79 HTT (0.50) RAB9AGAAHTTL3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5622976-A NERVOUS SYSTEM DISORDERS; ALZHEIMER*S DISEASE; CEREBROVASCULAR DISORDERS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-04-22 US disclosed
EP-0619814-A1 OXADIAZOLE DERIVATIVES HAVING ACETYLCHOLINESTERASE-INHIBITORY AND MUSCARINIC AGONIST ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-10-19 EP disclosed
WO-1993013083-A1 OXADIAZOLE DERIVATIVES HAVING ACETYLCHOLINESTERASE-INHIBITORY AND MUSCARINIC AGONIST ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-07-08 WO disclosed