SCHEMBL8679148

SCHEMBL8679148

CCCCC(CCCC)C(N)OC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.39
CA1 P00915 3/20 0.39
PRKCA P17252 2/20 0.39
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
ALDH1A1 P00352 1/20 0.39
DPP7 Q9UHL4 3/20 0.38
SLC15A1 P46059 1/20 0.38
TSHR P16473 2/20 0.37
CYP3A4 P08684 1/20 0.37
ATM Q13315 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PLA2G2C Q5R387 1/20 0.37
MAPK1 P28482 1/20 0.36
DPP8 Q6V1X1 2/20 0.35
DPP4 P27487 1/20 0.35
DPP9 Q86TI2 1/20 0.35

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
SCHEMBL3023868 0.92 CA2 (0.41) CA2CA1PRKCASLC1A3SLC1A2
SCHEMBL221495 0.79 SLC1A2 (0.46) CA2CA1PRKCASLC1A3SLC1A2
SCHEMBL11592266 0.79 TSHR (0.40) PRKCASLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL9774213 0.78 LMNA (0.58) PRKCAALDH1A1TSHRCYP3A4ATM
SCHEMBL3079688 0.78 SLC1A2 (0.44) CA2CA1PRKCASLC1A3SLC1A2
SCHEMBL11425236 0.77 PRKCA (0.44) CA2CA1PRKCACYP3A4
SCHEMBL11587587 0.75 CA2 (0.39) CA2CA1SLC1A3SLC1A2SLC1A1
SCHEMBL28471274 0.74 CA2 (0.40) CA2CA1PRKCAALDH1A1TSHR
SCHEMBL29196554 0.74 CA2 (0.36) CA2CA1PRKCASLC1A3SLC1A2
SCHEMBL11140994 0.74 ALDH1A1 (0.44) CA2CA1PRKCAALDH1A1TSHR

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-5726241-A Finishing oil for precursor for high performance carbon fibers and precursor HEXCEL CORPORATION (US) 1998-03-10 US disclosed
US-5571442-A SILICONE OIL, DICARBOXYLIC ACID MONOESTER EMULSIFIER, AMINOCARBOXYLIC ACID MATSUMOTO YUSHI-SEIYAKU CO., LTD. (JP) 1996-11-05 US disclosed