SCHEMBL10633859

SCHEMBL10633859

O=C(O)CCNC(=O)CCNC(=O)CCC1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.54
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.48
EPHX1 P07099 1/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ITGB3 P05106 2/20 0.45
ITGA2B P08514 2/20 0.45
F2R P25116 2/20 0.45
EPHX2 P34913 1/20 0.45
GLA P06280 1/20 0.44
KDM5A P29375 2/20 0.44
PHF8 Q9UPP1 2/20 0.44
KDM2A Q9Y2K7 2/20 0.44
KDM4C Q9H3R0 1/20 0.44
KDM4A O75164 1/20 0.44
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL10633798 1.00 HPGD (0.54) HPGDALDH1A1SMN1; SMN2EPHX1MEN1
SCHEMBL13618530 0.88 HPGD (0.57) HPGDALDH1A1EPHX1MEN1KMT2A
SCHEMBL21882669 0.81 KDM5A (0.50) HPGDALDH1A1EPHX1MEN1KMT2A
SCHEMBL7286378 0.81 HDAC3 (0.51) HPGDALDH1A1SMN1; SMN2EPHX1EPHX2
SCHEMBL25911804 0.81 KDM5A (0.50) HPGDALDH1A1EPHX1MEN1KMT2A
SCHEMBL8848118 0.81 HPGD (0.56) HPGDALDH1A1EPHX1MEN1KMT2A
SCHEMBL24882522 0.80 KDM5A (0.52) HPGDALDH1A1EPHX1MEN1KMT2A
SCHEMBL9071922 0.80 EPHX2 (0.57) HPGDALDH1A1EPHX1MEN1KMT2A
SCHEMBL11024174 0.79 HPGD (0.55) HPGDALDH1A1SMN1; SMN2EPHX1MEN1
SCHEMBL9130865 0.79 HPGD (0.55) HPGDALDH1A1SMN1; SMN2EPHX1MEN1

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
US-4781977-A WATER-INSOLUBLE RESIN-SPACER-LIGAND SANRAKU INCORPORATED (JP) 1988-11-01 US disclosed
EP-0220719-A2 Cyclodextrin absorbing material and its use Sanraku Incorporated (JP) 1987-05-06 EP disclosed