SCHEMBL11244518

SCHEMBL11244518

CC(C)(C)COP(O)Oc1ccc(C(C)(C)c2ccc(OP(O)OCC(C)(C)C)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.39
HTT P42858 2/20 0.39
HPGD P15428 3/20 0.36
TSHR P16473 3/20 0.36
CYP3A4 P08684 3/20 0.36
AR P10275 2/20 0.36
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
HTR6 P50406 1/20 0.36
ESRRG P62508 1/20 0.36
SLC6A3 Q01959 1/20 0.36
HSD17B10 Q99714 1/20 0.36
KMT2A Q03164 5/20 0.36
ALDH1A1 P00352 5/20 0.36
MEN1 O00255 4/20 0.36
TP53 P04637 2/20 0.36
MAPT P10636 2/20 0.36
CYP1A2 P05177 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
SCHEMBL2379764 0.82 RIPK1 (0.36) HPGDTSHRALDH1A1MAPTRAB9A
SCHEMBL13052137 0.75 ESR1 (0.46) HIF1AHTTHPGDTSHRCYP3A4
SCHEMBL5179757 0.74 ESR1 (0.44) HIF1AHTTHPGDTSHRCYP3A4
SCHEMBL9347364 0.74 LPL (0.45) HIF1ACYP3A4ESR1SLC6A2SLC6A4
Bisphenol A SCHEMBL8775284 0.74 ESR1 (0.57) HPGDTSHRCYP3A4ARESR1
SCHEMBL2031764 0.72 NR5A1 (0.51) HIF1AHPGDTSHRCYP3A4AR
SCHEMBL2029789 0.72 NR5A1 (0.51) HIF1AHPGDTSHRCYP3A4AR
SCHEMBL2034351 0.72 NR5A1 (0.51) HIF1AHPGDTSHRCYP3A4AR
SCHEMBL2038524 0.72 NR5A1 (0.51) HIF1AHPGDTSHRCYP3A4AR
SCHEMBL9377006 0.71 CYP3A4 (0.57) HIF1AHTTTSHRCYP3A4ESR1

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-4312803-A BIPHOSPHITE STABILIZER GENERAL ELECTRIC COMPANY (US) 1982-01-26 US disclosed