SCHEMBL28756702

SCHEMBL28756702

[CH2]C(O)Cn1cc([N+](=O)[O-])nc1Cl

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
PKM P14618 2/20 0.41
KMT2A Q03164 3/20 0.41
SOS1 Q07889 1/20 0.39
MITF O75030 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.35
POLB P06746 1/20 0.34
CHRM1 P11229 1/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL27629456 0.85 ALDH1A1 (0.46) ALDH1A1PKMKMT2ASOS1MITF
SCHEMBL27610264 0.85 ALDH1A1 (0.46) ALDH1A1PKMKMT2ASOS1MITF
SCHEMBL28523274 0.84 ALDH1A1 (0.42) ALDH1A1PKMKMT2ASOS1MITF
SCHEMBL28523272 0.84 ALDH1A1 (0.42) ALDH1A1PKMKMT2ASOS1MITF
SCHEMBL5539609 0.84 CHRM1 (0.47) ALDH1A1PKMKMT2ASOS1MITF
SCHEMBL28531344 0.84 CHRM1 (0.47) ALDH1A1PKMKMT2ASOS1MITF
SCHEMBL2224586 0.81 ALDH1A1 (0.47) ALDH1A1PKMKMT2ASOS1MITF
SCHEMBL17984901 0.79 ALDH1A1 (0.44) ALDH1A1PKMKMT2ASOS1MITF
SCHEMBL5316860 0.79 ALDH1A1 (0.41) ALDH1A1PKMKMT2ASOS1MITF
SCHEMBL12517676 0.78 ALDH1A1 (0.38) ALDH1A1PKMKMT2ASOS1MITF

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