SCHEMBL6677579

SCHEMBL6677579

CCCCOc1ccc(OCCCC)c(C([NH])=O)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 4/20 0.48
L3MBTL1 Q9Y468 2/20 0.46
THRB P10828 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.46
S1PR3 Q99500 1/20 0.45
MEN1 O00255 1/20 0.44
NR1I2 O75469 1/20 0.44
CHRM2 P08172 1/20 0.44
CYP3A4 P08684 1/20 0.44
ADRA2A P08913 1/20 0.44
OPRK1 P41145 1/20 0.44
HTR2B P41595 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KMT2A Q03164 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44

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
SCHEMBL16190196 0.85 PTPN11 (0.59) PTPN11S1PR3
SCHEMBL6558451 0.85 LMNA (0.57) L3MBTL1LMNAMAPTCYP3A4
SCHEMBL6677588 0.84 LMNA (0.59) PTPN11L3MBTL1ALDH1A1LMNAMAPT
SCHEMBL5861881 0.83 CNR2 (0.50) L3MBTL1ALDH1A1TDP1LMNAMAPT
SCHEMBL35211213 0.83 PTPN11 (0.64) PTPN11S1PR3
SCHEMBL11333568 0.82 TSHR (0.59) PTPN11L3MBTL1ALDH1A1TDP1LMNA
SCHEMBL9417624 0.81 PTPN11 (0.67) PTPN11S1PR3
SCHEMBL25788077 0.81 PTPN11 (0.67) PTPN11S1PR3
SCHEMBL7089316 0.80 MEN1 (0.67) PTPN11THRBLMNAMAPTS1PR3
SCHEMBL7766053 0.80 LMNA (0.62) L3MBTL1THRBALDH1A1TDP1LMNA

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-20040220054-A1 Recording material FUJI PHOTO FILM CO., LTD. 2004-11-04 US disclosed
EP-1473591-A1 Recording material FUJI PHOTO FILM CO., LTD. (JP) 2004-11-03 EP disclosed