SCHEMBL9801228

SCHEMBL9801228

CC(O)CN1CCOCC1C

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
USP2 O75604 1/20 0.35
LTA4H P09960 1/20 0.35
ALDH1A1 P00352 1/20 0.33
PDK1 Q15118 3/20 0.31
PDK2 Q15119 1/20 0.31
PDK3 Q15120 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
GAA P10253 1/20 0.30
TP53 P04637 1/20 0.30
MDM2 Q00987 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
SCHEMBL17354511 0.85 CA12 (0.38) CA12CA1CA2CA9LTA4H
SCHEMBL27281487 0.85 CA12 (0.38) CA12CA1CA2CA9LTA4H
SCHEMBL26660549 0.85 CA12 (0.38) CA12CA1CA2CA9LTA4H
SCHEMBL31396823 0.82 CA12 (0.38) CA12CA1CA2CA9LTA4H
SCHEMBL9801238 0.81 CA12 (0.36) CA12CA1CA2CA9LTA4H
SCHEMBL6448920 0.81
SCHEMBL9801626 0.79 PDK1 (0.37) USP2ALDH1A1PDK1PDK2PDK3
SCHEMBL28499384 0.76
SCHEMBL17828075 0.76 LTA4H (0.34) CA12CA1CA2CA9LTA4H
SCHEMBL17828076 0.76 LTA4H (0.34) CA12CA1CA2CA9LTA4H

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
US-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 US disclosed