SCHEMBL8924906

SCHEMBL8924906

[CH2]CCOC(=O)CCNCCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.41
LTA4H P09960 5/20 0.39
ALDH1A1 P00352 1/20 0.36
GLA P06280 1/20 0.36
PAOX Q6QHF9 1/20 0.36
TOP2A P11388 1/20 0.35
ADRA2A P08913 1/20 0.35
ADRA1A P35348 1/20 0.35
DNM1 Q05193 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.34
BLM P54132 1/20 0.34
HTR2C P28335 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
NAAA Q02083 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
TSHR P16473 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
SCHEMBL889155 0.86 ALDH1A1 (0.45) DGKALTA4HALDH1A1GLAPAOX
SCHEMBL8851605 0.80 GAA (0.52) LTA4HALDH1A1PAOXTOP2AMAPT
SCHEMBL12792361 0.80 NAAA (0.58) DGKADNM1HTR2CPRSS1PRSS2
SCHEMBL12792310 0.80 NAAA (0.58) DGKADNM1HTR2CPRSS1PRSS2
SCHEMBL128904 0.80
SCHEMBL13659026 0.79 DGKA (0.55) DGKALTA4HALDH1A1DNM1LMNA
SCHEMBL7279379 0.78 DGKA (0.48) DGKAALDH1A1GLATOP2AADRA2A
SCHEMBL21182396 0.77 TSHR (0.54) DGKALTA4HALDH1A1PAOXDNM1
SCHEMBL889250 0.77 DGKA (0.48) DGKALTA4HALDH1A1GLAPAOX
SCHEMBL11511633 0.77 GAA (0.48) LTA4HALDH1A1TOP2AMAPT

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-5639770-A SUPEROXIDE INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-06-17 US disclosed
EP-0600092-A1 THIAZOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-08 EP disclosed