SCHEMBL5226380

SCHEMBL5226380

O=C(O)N1C(=O)COc2cccnc21

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 1/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.38
KDM4E B2RXH2 1/20 0.37
USP19 O94966 1/20 0.36
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
RIPK1 Q13546 6/20 0.35
MYC P01106 1/20 0.35
NPC1 O15118 1/20 0.35
KMT2A Q03164 2/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
MEN1 O00255 1/20 0.35

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
SCHEMBL5418613 0.83 ALDH1A1 (0.39) ALDH1A1MAPTTSHR
SCHEMBL30336156 0.76 CYP11B1 (0.47) NR3C2RIPK1
SCHEMBL4067526 0.76 CYP11B1 (0.47) NR3C2RIPK1
SCHEMBL18237838 0.76 USP19 (0.41) NR3C2ALDH1A1MAPTTSHRKDM4E
SCHEMBL4790977 0.75 CD74 (0.43) NR3C2ALDH1A1KDM4EUSP19KMT2A
SCHEMBL5227565 0.74 KMT2A (0.50) ALDH1A1MAPTTSHRKDM4EKMT2A
SCHEMBL18937273 0.73 USP19 (0.38) NR3C2ALDH1A1MAPTKDM4EUSP19
SCHEMBL15204409 0.72 RIPK1 (0.39) NR3C2RIPK1
SCHEMBL15204408 0.72 RIPK1 (0.39) NR3C2RIPK1
SCHEMBL19859246 0.71 CYP11B2 (0.47) MAPTKMT2A

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
EP-1556387-B1 SUBSTITUTED BENZOL E| 1,4| OXAZINO 3,2-G| ISOINDOLE DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SERVIER LAB (FR) 2007-04-04 EP disclosed
EP-1556387-A1 SUBSTITUTED BENZOL E] 1,4] OXAZINO 3,2-G] ISOINDOLE DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Les Laboratoires Servier (FR) 2005-07-27 EP disclosed
WO-2004037830-A1 SUBSTITUTED BENZOL[E] [1,4] OXAZINO[3,2-G] ISOINDOLE DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2004-05-06 WO disclosed