SCHEMBL10151110

SCHEMBL10151110

CC(C)C(C)C(=O)OC12CC3CC(C1)CC(C(=O)O)(C3)C2

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.36
CYP17A1 P05093 3/20 0.35
CYP19A1 P11511 3/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GAA P10253 1/20 0.33
POLB P06746 1/20 0.32
HSD11B1 P28845 1/20 0.32
THRB P10828 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
SCHEMBL11941701 0.91 ALDH1A1 (0.40) ALDH1A1L3MBTL1PKMKMT2ACYP17A1
SCHEMBL13943335 0.88 ALDH1A1 (0.42) ALDH1A1L3MBTL1PKMKMT2ACYP17A1
SCHEMBL11966903 0.83 ALDH1A1 (0.42) ALDH1A1L3MBTL1PKMKMT2ACYP17A1
SCHEMBL11991219 0.82 DPP4 (0.37) ALDH1A1CYP17A1CYP19A1NPSR1THRB
SCHEMBL12897861 0.82 CYP17A1 (0.36) ALDH1A1L3MBTL1PKMCYP17A1CYP19A1
SCHEMBL11991223 0.81 CYP19A1 (0.48) ALDH1A1CYP17A1CYP19A1NPSR1HSD11B1
SCHEMBL26030806 0.81 CYP17A1 (0.36) CYP17A1CYP19A1NPSR1
SCHEMBL5608294 0.80 ALDH1A1 (0.50) ALDH1A1L3MBTL1PKMKMT2AGAA
SCHEMBL5607877 0.80 ALDH1A1 (0.49) ALDH1A1L3MBTL1PKMKMT2ANPSR1
SCHEMBL18844948 0.79 ALDH1A1 (0.41) ALDH1A1L3MBTL1PKMKMT2ANPSR1

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-8105764-B2 Patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-01-31 US disclosed
US-20090081595-A1 PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2009-03-26 US disclosed