SCHEMBL11544779

SCHEMBL11544779

CC(C)(C)c1ccc(OCC(O)COc2ccc(C3OCCO3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
GAA P10253 1/20 0.48
LMNA P02545 3/20 0.46
HSD17B10 Q99714 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
KDM4E B2RXH2 3/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
ALDH1A1 P00352 3/20 0.44
USP2 O75604 1/20 0.44
HTT P42858 2/20 0.44
HIF1A Q16665 1/20 0.44
TSHR P16473 1/20 0.44
AR P10275 1/20 0.43
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
POLB P06746 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL15677148 0.82 MAPT (0.63) MAPTGAALMNAHSD17B10SMN1; SMN2
SCHEMBL11547071 0.82 CYP1A2 (0.51) MAPTLMNAHSD17B10NPC1RAB9A
SCHEMBL2680437 0.79 LMNA (0.43) LMNASMN1; SMN2KDM4ERAB9AALDH1A1
SCHEMBL15677170 0.78 MAPT (0.58) MAPTGAALMNAHSD17B10SMN1; SMN2
SCHEMBL822725 0.76 MAPT (0.72) MAPTGAALMNAHSD17B10SMN1; SMN2
SCHEMBL11937238 0.76 TP53 (0.54) MAPTLMNASMN1; SMN2KDM4ERAB9A
SCHEMBL15677168 0.76 MAPT (0.57) MAPTGAALMNAHSD17B10SMN1; SMN2
SCHEMBL14922116 0.76 CYP2D6 (0.59) MAPTGAALMNAHSD17B10SMN1; SMN2
SCHEMBL31098425 0.75 LMNA (0.59) MAPTGAALMNAHSD17B10SMN1; SMN2
SCHEMBL13761600 0.75 AR (0.69) MAPTGAALMNAHSD17B10SMN1; SMN2

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-4144351-A ANTICHOLESTEROL KLINGE PHARMA GMBH & CO. (DE) 1979-03-13 US claimed