SCHEMBL500099

SCHEMBL500099

COC(=O)CC1CCCCN1CCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 6/20 0.47
OPRD1 P41143 1/20 0.44
TERT O14746 4/20 0.39
HRH3 Q9Y5N1 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TSHR P16473 2/20 0.36

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
SCHEMBL19349848 0.91 SMN1; SMN2 (0.44) LTA4HOPRD1TERTHRH3SMN1; SMN2
SCHEMBL863635 0.86 SMN1; SMN2 (0.45) LTA4HOPRD1HRH3SMN1; SMN2TSHR
SCHEMBL6922946 0.86 SMN1; SMN2 (0.45) LTA4HOPRD1HRH3SMN1; SMN2TSHR
SCHEMBL19360212 0.85 ALDH1A1 (0.42) OPRD1TERTHRH3SMN1; SMN2TSHR
SCHEMBL12706905 0.80 OPRD1 (0.47) OPRD1HRH3
SCHEMBL9181496 0.80 TERT (0.51) LTA4HOPRD1TERTTSHR
SCHEMBL10232077 0.79 OPRD1 (0.40) OPRD1HRH3SMN1; SMN2
SCHEMBL24872393 0.78 CYP1A2 (0.44)
SCHEMBL19570919 0.78 OPRD1 (0.54) OPRD1
SCHEMBL19349921 0.77 L3MBTL1 (0.37) OPRD1

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