SCHEMBL3396860

SCHEMBL3396860

CCC(CCOc1ccc(C)cc1)C(N)O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.44
USP2 O75604 1/20 0.42
TSHR P16473 1/20 0.42
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
DRD3 P35462 1/20 0.41
WDR5 P61964 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PTGES O14684 1/20 0.40
ALOX5 P09917 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
ATM Q13315 1/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL24418950 0.81 L3MBTL1 (0.50) MEN1KMT2AL3MBTL1USP2TSHR
SCHEMBL3400186 0.81 MEN1 (0.48) MEN1KMT2AL3MBTL1USP2TSHR
SCHEMBL3399537 0.80 TDP1 (0.47) MEN1KMT2AL3MBTL1USP2TSHR
SCHEMBL3400711 0.77 TDP1 (0.47) MEN1KMT2AL3MBTL1USP2TSHR
SCHEMBL3402151 0.76 SCN4A (0.47) TSHR
SCHEMBL14959985 0.75 L3MBTL1 (0.52) MEN1KMT2AL3MBTL1USP2TSHR
SCHEMBL10698935 0.75 L3MBTL1 (0.52) MEN1KMT2AL3MBTL1USP2TSHR
SCHEMBL9479987 0.75 TDP1 (0.53) MEN1KMT2AL3MBTL1DRD2DRD4
SCHEMBL12482374 0.74 MEN1 (0.50) MEN1KMT2AL3MBTL1DRD2DRD4
SCHEMBL23711162 0.73 L3MBTL1 (0.49) MEN1KMT2AL3MBTL1USP2TSHR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101932551-A Aminoalkanol derivatives, process for producing aminoalkanols and use thereof UNIV JAGIELLONSKI 2010-12-29 CN claimed
EP-2247571-A2 DERIVATIVES OF AMINOALKANOLS, METHOD OF OBTAINING OF AMINOALKANOLS AND THEIR USE Uniwersytet Jagiellonski (PL) 2010-11-10 EP claimed
WO-2009093916-A2 DERIVATIVES OF AMINOALKANOLS, METHOD OF OBTAINING AMINOALKANOLS AND THEIR USE UNIWERSYTET JAGIELLONSKI (PL) 2009-07-30 WO claimed
CN-101932551-A Aminoalkanol derivatives, process for producing aminoalkanols and use thereof UNIV JAGIELLONSKI 2010-12-29 CN disclosed