SCHEMBL17481964

SCHEMBL17481964

CN(C)CCNC(=O)c1cc(CO)on1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.47
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
MAPK1 P28482 1/20 0.45
HDAC6 Q9UBN7 4/20 0.45
HPGD P15428 2/20 0.45
USP2 O75604 1/20 0.45
HTT P42858 1/20 0.43
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
HSD17B10 Q99714 1/20 0.43
HDAC1 Q13547 3/20 0.43
HDAC4 P56524 2/20 0.43
POLB P06746 2/20 0.42
THRB P10828 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42

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
SCHEMBL17483171 0.93 POLB (0.49) SMN1; SMN2RAB9ANPC1MAPK1HDAC6
SCHEMBL17483118 0.90 POLB (0.47) SMN1; SMN2RAB9ANPC1MAPK1HDAC6
SCHEMBL19484079 0.88 THRB (0.54) SMN1; SMN2RAB9ANPC1MAPK1HDAC6
SCHEMBL17483210 0.84 RAB9A (0.47) SMN1; SMN2RAB9ANPC1MAPK1HPGD
SCHEMBL17482985 0.83 RAB9A (0.55) SMN1; SMN2RAB9ANPC1MAPK1HDAC6
SCHEMBL17483094 0.82 RAB9A (0.48) SMN1; SMN2RAB9ANPC1MAPK1HPGD
SCHEMBL2360704 0.82 LMNA (0.57) SMN1; SMN2RAB9ANPC1USP2HTT
SCHEMBL17483168 0.82 RAB9A (0.49) SMN1; SMN2RAB9ANPC1MAPK1HDAC6
SCHEMBL19484067 0.81 THRB (0.53) SMN1; SMN2RAB9ANPC1MAPK1HPGD
SCHEMBL17483183 0.81 RAB9A (0.43) SMN1; SMN2RAB9ANPC1MAPK1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016017467-A1 AMIDE COMPOUND AND USE OF SAME FOR NOXIOUS ARTHROPOD CONTROL 住友化学株式会社 2016-02-04 WO disclosed