SCHEMBL28753498

SCHEMBL28753498

CC1(CN2c3cc(-c4ccccc4)ccc3OC2C=O)CO1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2B P41595 2/20 0.40
▸ TMEM97 Q5BJF2 2/20 0.40
▸ SIGMAR1 Q99720 2/20 0.40
▸ HTR1A P08908 1/20 0.40
▸ HTR7 P34969 1/20 0.39
▸ HRH3 Q9Y5N1 3/20 0.34
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ BRD4 O60885 2/20 0.32
▸ CHRNB4 P30926 3/20 0.32
▸ CHRNA3 P32297 3/20 0.32
▸ PIK3CD O00329 2/20 0.32
▸ PIK3CB P42338 2/20 0.32
▸ PIK3CG P48736 2/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ CTSD P07339 1/20 0.31
▸ BACE1 P56817 1/20 0.31
▸ CHRNA1 P02708 1/20 0.30

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
SCHEMBL27630016 0.84 DRD2 (0.31) —
SCHEMBL27610487 0.83 PBRM1 (0.32) BACE1
SCHEMBL27610373 0.69 PRKCG (0.31) —
SCHEMBL27668682 0.68 TSHR (0.46) HTR1AKDM4EMEN1GAAKMT2A
SCHEMBL27668652 0.68 MAPK1 (0.49) KDM4EMEN1GAAKMT2A
SCHEMBL28247689 0.64 CLK1 (0.40) MEN1KMT2A
SCHEMBL5540024 0.63 TSPO (0.46) —
SCHEMBL14648788 0.62 MEN1 (0.38) HTR2BTMEM97SIGMAR1HTR1AHRH3
SCHEMBL10867310 0.60 BRD4 (0.38) HRH3KDM4EMEN1GAAKMT2A
SCHEMBL28756718 0.60 ALDH1A1 (0.37) MEN1GAAKMT2A

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
CN-101255170-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-09-03 — — CN disclosed
CN-101172981-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-05-07 — — CN disclosed
CN-1705670-A 2, 3-dihydro-6-nitroimidazo [2, 1-b ] oxazole compounds OTSUKA PHARMA CO LTD (JP) 2005-12-07 — — CN disclosed
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