SCHEMBL10027503

SCHEMBL10027503

CCOC(=O)C(C)(C)CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(C)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.48
CYP4A11 Q02928 3/20 0.48
ALDH1A1 P00352 3/20 0.39
PKM P14618 3/20 0.38
MMP8 P22894 2/20 0.38
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.37
THRB P10828 1/20 0.36
ABCB11 O95342 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
HTR2A P28223 1/20 0.36
PMP22 Q01453 1/20 0.36
PPARA Q07869 1/20 0.36
ALOX15 P16050 1/20 0.36
MGAM O43451 1/20 0.36

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
SCHEMBL12757296 0.94 CYP4F2 (0.44) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL18232353 0.94 CYP4F2 (0.44) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL12384015 0.89 CYP4F2 (0.47) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL18363110 0.86 CYP4F2 (0.55) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL15275769 0.82 CYP4F2 (0.39) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL14873553 0.82 CYP4F2 (0.52) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL16866705 0.81 CYP4F2 (0.45) CYP4F2CYP4A11PKMMMP8KDM4E
SCHEMBL15180191 0.81 CYP4F2 (0.42) CYP4F2CYP4A11PKMMMP8KDM4E
SCHEMBL16866713 0.80 CYP4F2 (0.47) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL18961219 0.80 CYP4F2 (0.33) CYP4F2CYP4A11

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-20120021356-A1 LITHOGRAPHIC PRINTING PLATE SUPPORT AND PRESENSITIZED PLATE FUJIFILM CORPORATION (JP) 2012-01-26 US disclosed