SCHEMBL12936734

SCHEMBL12936734

CCCC(=O)OC1(CC)C2CC3CC(C2)CC1C3

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
CYP17A1 P05093 1/20 0.36
CYP19A1 P11511 1/20 0.36
EPHX2 P34913 4/20 0.33
HSD11B1 P28845 3/20 0.32
TSHR P16473 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL10228820 0.86 CYP17A1 (0.32) L3MBTL1CYP17A1CYP19A1HSD11B1
SCHEMBL13527863 0.86 CYP17A1 (0.32) L3MBTL1CYP17A1CYP19A1HSD11B1
SCHEMBL172815 0.85 CYP17A1 (0.35) ALDH1A1CYP17A1CYP19A1HSD11B1
SCHEMBL12197282 0.84 CYP17A1 (0.49) ALDH1A1L3MBTL1CYP17A1CYP19A1EPHX2
SCHEMBL13588102 0.83 ALDH1A1 (0.33) ALDH1A1CYP17A1CYP19A1
SCHEMBL853162 0.82 EPHX2 (0.37) ALDH1A1EPHX2MEN1KMT2A
SCHEMBL11913499 0.82 FAAH (0.34) ALDH1A1CYP17A1CYP19A1
SCHEMBL2672518 0.82 TRPA1 (0.36) ALDH1A1CYP17A1CYP19A1HSD11B1
SCHEMBL4741912 0.82 CYP17A1 (0.33) CYP17A1CYP19A1HSD11B1
SCHEMBL210241 0.82 CYP17A1 (0.33) ALDH1A1L3MBTL1CYP17A1CYP19A1EPHX2

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-8846294-B2 Photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-30 US disclosed
US-20120251946-A1 PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-04 US disclosed