SCHEMBL11298604

SCHEMBL11298604

CCOC(=O)C1(CCCCOc2ccccc2)CO1

nearest known ligand 0.76

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.76
LMNA P02545 3/20 0.76
MAPK1 P28482 2/20 0.76
ABCB11 O95342 1/20 0.76
TDP1 Q9NUW8 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.47
NPC1 O15118 1/20 0.47
GAA P10253 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 6/20 0.47
MEN1 O00255 5/20 0.47
ALDH1A1 P00352 3/20 0.47
OPRM1 P35372 2/20 0.47
OPRD1 P41143 2/20 0.47
P4HB P07237 1/20 0.46
KDM4E B2RXH2 1/20 0.45

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
SCHEMBL957321 0.99 MAPT (0.78) MAPTLMNAMAPK1ABCB11TDP1
SCHEMBL11292121 0.99 MAPT (0.78) MAPTLMNAMAPK1ABCB11TDP1
SCHEMBL11288785 0.96 MAPT (0.70) MAPTLMNAMAPK1ABCB11TDP1
SCHEMBL11292129 0.92 LMNA (0.64) MAPTLMNAMAPK1ABCB11TDP1
SCHEMBL11288224 0.90 MAPT (0.80) MAPTLMNAMAPK1ABCB11GAA
SCHEMBL14769764 0.88 MAPT (0.82) MAPTLMNAMAPK1ABCB11GAA
SCHEMBL11295685 0.88 MAPK1 (0.66) MAPTLMNAMAPK1ABCB11TDP1
SCHEMBL11290623 0.87 LMNA (0.76) MAPTLMNAMAPK1ABCB11SMN1; SMN2
SCHEMBL11287515 0.86 MAPK1 (0.75) MAPTLMNAMAPK1ABCB11SMN1; SMN2
SCHEMBL11297622 0.86 ABCB11 (0.78) MAPTLMNAMAPK1ABCB11SMN1; 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-4337267-A HYPOKETONEMIC, HYPOGLYCEMIC, ANTIDIABETIC BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1982-06-29 US disclosed