SCHEMBL500155

SCHEMBL500155

O=C(O)CC(CCO)N1CCCC1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 1/20 0.35
SLC6A3 Q01959 3/20 0.33
CYP1A2 P05177 2/20 0.33
MAPK1 P28482 2/20 0.33
SLC6A2 P23975 2/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
SLC6A4 P31645 1/20 0.32
HTT P42858 1/20 0.32
SLC22A6 Q4U2R8 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
REN P00797 1/20 0.30
ACE P12821 1/20 0.30
GAA P10253 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL22060499 0.83 IDO1 (0.41) SLC6A3CYP1A2CYP2C19TDP1
SCHEMBL11844785 0.79 GPR84 (0.42) SLC6A3MAPK1SLC6A2SLC6A4TDP1
SCHEMBL21124671 0.79
SCHEMBL10025245 0.78 SLC6A3 (0.49) DPP7SLC6A3CYP1A2MAPK1SLC6A2
SCHEMBL10566713 0.76 SLC6A3 (0.48) DPP7SLC6A3CYP1A2MAPK1SLC6A2
SCHEMBL20141889 0.76 GPR84 (0.42) SLC6A3MAPK1SLC6A2TDP1
SCHEMBL10885050 0.73 SLC6A3 (0.45) DPP7SLC6A3SLC6A2SLC6A4LMNA
SCHEMBL500531 0.73 ALDH1A1 (0.32) SLC6A3MAPK1SLC6A2SLC6A4LMNA
SCHEMBL5248220 0.71 FDPS (0.31)
SCHEMBL27715717 0.71 SLC6A3 (0.38) SLC6A3SLC6A2SLC6A4

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-8105760-B2 Patterning process and pattern surface coating composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-01-31 US disclosed
US-20090053657-A1 PATTERNING PROCESS AND PATTERN SURFACE COATING COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2009-02-26 US disclosed