SCHEMBL800014

SCHEMBL800014

C=C(OCC(=O)OC(C)(C)C)C(C)(C)CC

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL106999 0.81 CYP4F2 (0.34) MEN1GAAKMT2AL3MBTL1
SCHEMBL799997 0.75
SCHEMBL27697176 0.74 NAAA (0.39) MEN1GAAKMT2AL3MBTL1
SCHEMBL6935674 0.73 ALDH1A1 (0.38) MEN1GAAKMT2AL3MBTL1
SCHEMBL2734950 0.73 TSHR (0.44) MEN1GAAKMT2AL3MBTL1
SCHEMBL14370447 0.72 APLNR (0.31) MEN1GAAKMT2AL3MBTL1
SCHEMBL12905043 0.71 GAA (0.44) MEN1GAAKMT2AL3MBTL1
SCHEMBL1688820 0.71 ALDH1A1 (0.40) MEN1GAAKMT2AL3MBTL1
SCHEMBL6935677 0.71 KMT2A (0.34) MEN1GAAKMT2AL3MBTL1
SCHEMBL126977 0.71 ALDH1A1 (0.44) MEN1KMT2AL3MBTL1

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-20120070782-A1 SELF-FORMING TOP ANTI-REFLECTIVE COATING COMPOSITIONS AND, PHOTORESIST MIXTURES AND METHOD OF IMAGING USING SAME INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-03-22 US disclosed