SCHEMBL9128474

SCHEMBL9128474

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

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
SOAT1 P35610 1/20 0.40
CYP4F2 P78329 2/20 0.33
CYP4A11 Q02928 2/20 0.33
PKM P14618 2/20 0.33
THRB P10828 1/20 0.33
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HTT P42858 1/20 0.32
GAA P10253 2/20 0.31
ALOX15 P16050 1/20 0.31
MGAM O43451 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
MMP8 P22894 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL7940095 0.82 ALDH1A1 (0.32) ALDH1A1SOAT1
SCHEMBL28453569 0.81 ALDH1A1 (0.46) ALDH1A1SOAT1CYP4F2CYP4A11PKM
SCHEMBL28440470 0.80 ALDH1A1 (0.50) ALDH1A1SOAT1CYP4F2CYP4A11PKM
SCHEMBL2966186 0.76 ALDH1A1 (0.41) ALDH1A1SOAT1LMNAHSD17B10GAA
SCHEMBL2964690 0.76 ALDH1A1 (0.44) ALDH1A1SOAT1CYP4F2CYP4A11PKM
SCHEMBL30595886 0.75 ALDH1A1 (0.40) ALDH1A1SOAT1CYP4F2CYP4A11PKM
SCHEMBL4576278 0.75 ALDH1A1 (0.67) ALDH1A1SOAT1PKMTHRBLMNA
SCHEMBL4759769 0.73 ALDH1A1 (0.41) ALDH1A1SOAT1LMNAHSD17B10GAA
SCHEMBL7927516 0.72 ALDH1A1 (0.50) ALDH1A1SOAT1CYP4F2CYP4A11PKM
SCHEMBL27897713 0.71 ALDH1A1 (0.55) ALDH1A1SOAT1CYP4F2CYP4A11PKM

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-5405915-A Ethylene polymer; crosslinking agent; nonaromatic, cyclic, unsaturated crosslinking co-agent; consistent tensile properties PHILLIPS PETROLEUM COMPANY (US) 1995-04-11 US disclosed