SCHEMBL6943581

SCHEMBL6943581

COCCCOc1cc([C@@H](CCO)C(C)C)ccc1OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
REN P00797 7/20 0.47
KDM4E B2RXH2 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
C5AR1 P21730 4/20 0.39
SMPD1 P17405 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
CYP3A4 P08684 1/20 0.38
HTR1A P08908 2/20 0.38
ADRA1D P25100 2/20 0.38
ADRA1A P35348 2/20 0.38
ADRA1B P35368 2/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
HTR2A P28223 1/20 0.37
HTR2B P41595 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL6947321 0.85 PPARG (0.43) RENSMPD1KMT2APRSS1
SCHEMBL6044557 0.80 MTNR1A (0.47) KDM4EC5AR1SMPD1HDAC1HDAC8
SCHEMBL6940750 0.78 ALOX5AP (0.47) TDP1F10RRM1
SCHEMBL6949104 0.78 ALOX5AP (0.47) TDP1F10RRM1
SCHEMBL6943578 0.76 MTNR1A (0.46) RENKDM4ETDP1C5AR1CYP3A4
SCHEMBL28041408 0.76 REN (0.49) RENKDM4ETDP1C5AR1HTR1A
SCHEMBL6044140 0.76 REN (0.48) REN
SCHEMBL6045096 0.76 REN (0.48) REN
SCHEMBL11832734 0.76 TAAR1 (0.51) KDM4ETDP1C5AR1MEN1POLB
SCHEMBL12524630 0.75 REN (0.50) RENKDM4ETDP1C5AR1SMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1266118-C Novel delta-amino-gamma-hydroxy-omega-aryl-alkanoic acid amides NOVARTIS AG (CH) 2006-07-26 CN disclosed
CN-1550491-A Novel delta-amino-gamma-hydroxy-omega-aryl-alkanoic acid amides ��˹��ŵ�� 2004-12-01 CN disclosed
CN-1153759-C Novel delta-amino-gamma hydroxy-omega-aryl-alkanamides ��˹��ŵ�� 2004-06-16 CN disclosed
WO-2003103653-A1 METHODS OF TREATING ALZHEIMER'S DISEASE USING ARYL ALKANOIC ACID AMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed
CN-1117960-A Novel delta-amino-gamma hydroxy-omega-aryl-alkanamides CIBA GEIGY AG (CH) 1996-03-06 CN disclosed