SCHEMBL10073953

SCHEMBL10073953

CCCCOC1C(OCCCC)[C@H](SCC)OC2COC(c3ccccc3)O[C@H]21

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
SELP P16109 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 1/20 0.32
PTAFR P25105 1/20 0.31
PPP5C P53041 1/20 0.31
ADRA1A P35348 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
SCHEMBL17636518 1.00 L3MBTL1 (0.47) L3MBTL1KMT2AMEN1SELPALDH1A1
SCHEMBL17550989 0.96 L3MBTL1 (0.53) L3MBTL1KMT2AMEN1SELPALDH1A1
SCHEMBL17550996 0.96 L3MBTL1 (0.53) L3MBTL1KMT2AMEN1SELPALDH1A1
SCHEMBL17550987 0.96 L3MBTL1 (0.53) L3MBTL1KMT2AMEN1SELPALDH1A1
SCHEMBL19682312 0.92 L3MBTL1 (0.53) L3MBTL1KMT2AMEN1SELPALDH1A1
SCHEMBL17550995 0.90 L3MBTL1 (0.43) L3MBTL1KMT2AMEN1SELPALDH1A1
SCHEMBL9909443 0.90 L3MBTL1 (0.43) L3MBTL1KMT2AMEN1SELPALDH1A1
SCHEMBL15197977 0.90 L3MBTL1 (0.43) L3MBTL1KMT2AMEN1SELPALDH1A1
SCHEMBL9909432 0.90 L3MBTL1 (0.43) L3MBTL1KMT2AMEN1SELPALDH1A1
SCHEMBL10183454 0.90 L3MBTL1 (0.47) L3MBTL1KMT2AMEN1SELPALDH1A1

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
WO-2012085668-A2 COMPOUNDS NOVARTIS AG (CH) 2012-06-28 WO disclosed