SCHEMBL27629324

SCHEMBL27629324

CC(O)(CCN1CCN(C(=O)O)CC1)Cn1cc([N+](=O)[O-])nc1Cl

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 3/20 0.33
MITF O75030 1/20 0.33
PKM P14618 1/20 0.32
KCNJ1 P48048 1/20 0.32
KCNH2 Q12809 1/20 0.32
SIGMAR1 Q99720 1/20 0.31
KDM4E B2RXH2 1/20 0.31
SOS1 Q07889 1/20 0.31
MAPK1 P28482 1/20 0.31
FAAH O00519 1/20 0.31
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL5541257 0.91 LMNA (0.39) LMNAKMT2AALDH1A1MITFPKM
SCHEMBL5535404 0.91 LMNA (0.39) LMNAKMT2AALDH1A1MITFPKM
SCHEMBL5535399 0.91 LMNA (0.39) LMNAKMT2AALDH1A1MITFPKM
SCHEMBL5542523 0.88 ALDH1A1 (0.41) LMNAKMT2AALDH1A1KCNH2POLB
SCHEMBL5543424 0.84 LMNA (0.34) LMNAKMT2AALDH1A1MITFPKM
SCHEMBL5546200 0.84 ACHE (0.37) LMNAKMT2AALDH1A1MITFKDM4E
SCHEMBL5546190 0.84 ACHE (0.37) LMNAKMT2AALDH1A1MITFKDM4E
SCHEMBL5543414 0.84 LMNA (0.34) LMNAKMT2AALDH1A1MITFPKM
SCHEMBL27610573 0.80 KMT2A (0.40) LMNAKMT2AALDH1A1MITFPKM
SCHEMBL6010609 0.79 ALDH1A1 (0.43) LMNAKMT2AALDH1A1KCNH2POLB

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
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-100366624-C 2, 3-dihydro-6-nitroimidazo [2,1-b ] * azole compounds OTSUKA PHARMA CO LTD (JP) 2008-02-06 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