SCHEMBL17599253

SCHEMBL17599253

O=C=NCN1CCCNC1=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 2/20 0.41
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
PER2 O15055 2/20 0.35
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33
CRY2 Q49AN0 1/20 0.33
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL17599259 0.89 ALDH1A1 (0.41) SMN1; SMN2MAPTALDH1A1KDM4EPER2
SCHEMBL17599243 0.82 SMN1; SMN2 (0.41) SMN1; SMN2MAPTALDH1A1KDM4EHPGD
SCHEMBL17599231 0.80 SMN1; SMN2 (0.39) SMN1; SMN2MAPTALDH1A1KDM4EHPGD
SCHEMBL17599226 0.78 SMN1; SMN2 (0.38) SMN1; SMN2MAPTALDH1A1KDM4EHPGD
SCHEMBL11479589 0.73 CHRM2 (0.46) ALDH1A1CYP2C9CYP2C19
SCHEMBL17599248 0.70 ALDH1A1 (0.41) SMN1; SMN2MAPTALDH1A1KDM4ECYP2C9
SCHEMBL22662833 0.70 SMN1; SMN2 (0.53) SMN1; SMN2MAPTALDH1A1KDM4EHPGD
SCHEMBL22559978 0.70
SCHEMBL20733275 0.70 SMN1; SMN2 (0.49) SMN1; SMN2MAPTALDH1A1KDM4EHPGD
SCHEMBL7976916 0.70

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
US-10253114-B2 Polyolefin modified with nitrogen-containing heterocyclic compound, and adhesive composition containing same TOYOBO CO., LTD. (JP) 2019-04-09 US disclosed
US-20160130373-A1 POLYOLEFIN MODIFIED WITH NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, AND ADHESIVE COMPOSITION CONTAINING SAME TOYOBO CO., LTD. (JP) 2016-05-12 US disclosed
EP-2998327-A1 POLYOLEFIN MODIFIED WITH NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, AND ADHESIVE COMPOSITION CONTAINING SAME TOYOBO CO., LTD. (JP) 2016-03-23 EP disclosed