SCHEMBL6003255

SCHEMBL6003255

O=C(CCO)NC1CCCCCC1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.69
ALDH1A1 P00352 2/20 0.68
HPGD P15428 2/20 0.66
EPHX1 P07099 7/20 0.59
KMT2A Q03164 1/20 0.59
HDAC3 O15379 2/20 0.58
HDAC1 Q13547 2/20 0.58
HDAC2 Q92769 2/20 0.58
HDAC10 Q969S8 2/20 0.58
HDAC11 Q96DB2 2/20 0.58
HDAC8 Q9BY41 2/20 0.58
HDAC6 Q9UBN7 2/20 0.58
NCOR2 Q9Y618 1/20 0.58
NPSR1 Q6W5P4 1/20 0.55
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
EPHX2 P34913 2/20 0.54
MAPT P10636 1/20 0.54
KDM4E B2RXH2 1/20 0.54
CYP3A4 P08684 1/20 0.54

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
SCHEMBL1698453 1.00 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1HPGDEPHX1KMT2A
SCHEMBL6002712 1.00 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1HPGDEPHX1KMT2A
SCHEMBL6002698 0.93 SMN1; SMN2 (0.65) SMN1; SMN2ALDH1A1HPGDEPHX1KMT2A
SCHEMBL6003417 0.89
SCHEMBL10587847 0.89 ALDH1A1 (0.83) SMN1; SMN2ALDH1A1HPGDEPHX1KMT2A
SCHEMBL7693790 0.88 SMN1; SMN2 (0.77) SMN1; SMN2ALDH1A1HPGDEPHX1KMT2A
SCHEMBL25825789 0.88 SMN1; SMN2 (0.77) SMN1; SMN2ALDH1A1HPGDEPHX1KMT2A
SCHEMBL8013586 0.86 SMN1; SMN2 (0.81) SMN1; SMN2ALDH1A1HPGDEPHX1KMT2A
SCHEMBL28668503 0.84 SMN1; SMN2 (0.95) SMN1; SMN2ALDH1A1HPGDEPHX1KMT2A
SCHEMBL9337868 0.84 SMN1; SMN2 (0.95) SMN1; SMN2ALDH1A1HPGDEPHX1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO disclosed