SCHEMBL6702779

SCHEMBL6702779

CCCCCCCCCC(=O)c1cc(OC)c(Cl)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
PAK1 Q13153 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.51
ALDH1A1 P00352 2/20 0.51
TSHR P16473 2/20 0.51
LMNA P02545 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
THRB P10828 3/20 0.51
THRA P10827 2/20 0.51
HTR4 Q13639 4/20 0.48
TRPV1 Q8NER1 2/20 0.47
GAA P10253 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
HTR2B P41595 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
ACHE P22303 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
SCHEMBL8575158 0.81 HTR4 (0.51) ALDH1A1LMNAHTR4GAAHTR2A
SCHEMBL11841115 0.80 STING1 (0.57) MEN1KMT2AHTR4ACHE
SCHEMBL10556328 0.78 SMN1; SMN2 (0.46) KMT2AL3MBTL1ALDH1A1TSHRLMNA
SCHEMBL10599678 0.78 GAA (0.67) MEN1KMT2APAK1L3MBTL1THRB
SCHEMBL10600889 0.78 GAA (0.67) MEN1KMT2APAK1L3MBTL1THRB
SCHEMBL8078006 0.78 GAA (0.67) MEN1KMT2APAK1L3MBTL1THRB
SCHEMBL27703528 0.77 HDAC8 (0.71) MEN1KMT2AL3MBTL1ALDH1A1TSHR
SCHEMBL6703841 0.77 ZDHHC7 (0.46) MEN1KMT2APAK1L3MBTL1ALDH1A1
SCHEMBL10772675 0.77 GAA (0.54) MEN1KMT2AL3MBTL1TSHRNPSR1
SCHEMBL14261447 0.77 GAA (0.54) MEN1KMT2AL3MBTL1TSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040198793-A1 Chemical process and new intermediates SANOFI-SYNTHELABO (FR) 2004-10-07 US disclosed
CN-1478075-A Chemical process and new intermediates ��ŵ�Ѻϳ�ʵ���� 2004-02-25 CN disclosed