SCHEMBL11948964

SCHEMBL11948964

CCC(C)C(=O)OCCCC(=O)OC1C2CC3CC(C2)CC1C3

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.35
EPHX2 P34913 13/20 0.34
CTSV O60911 1/20 0.33
CTSL P07711 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
EPHX1 P07099 1/20 0.32

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
SCHEMBL11948963 0.96 EPHX2 (0.39) HSD11B1EPHX2CTSVCTSLCTSS
SCHEMBL11948954 0.92 HSD11B1 (0.36) HSD11B1EPHX2CTSVCTSLCTSS
SCHEMBL11948970 0.85 EPHX2 (0.36) EPHX2
SCHEMBL11948913 0.83 HSD11B1 (0.37) HSD11B1EPHX2CTSVCTSLCTSS
SCHEMBL12198847 0.81 HSD11B1 (0.41) HSD11B1EPHX2CTSVCTSLCTSS
SCHEMBL12936721 0.78 NAAA (0.45) HSD11B1EPHX2CTSVCTSLCTSS
SCHEMBL11948965 0.77 HSD11B1 (0.34) HSD11B1EPHX2EPHX1
SCHEMBL11948966 0.77 EPHX2 (0.32) EPHX2
SCHEMBL11948958 0.77 HSD11B1 (0.35) HSD11B1EPHX2CTSVCTSLCTSS
SCHEMBL11948969 0.76 CYP17A1 (0.39) EPHX2

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-8232039-B2 Polymer and resist composition comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-31 US disclosed
US-20100124719-A1 Polymer and Resist Composition Comprising the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-20 US disclosed