SCHEMBL11949385

SCHEMBL11949385

COC(=O)CCC(C)CCCC(C)CCCC(C)C

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.52
LMNA P02545 2/20 0.50
TSHR P16473 3/20 0.48
PTPN1 P18031 3/20 0.46
CA12 O43570 2/20 0.40
CA14 Q9ULX7 2/20 0.40
SLC1A1 P43005 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
PTPN2 P17706 1/20 0.38
CDC25B P30305 1/20 0.38
TRPV1 Q8NER1 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CA1 P00915 1/20 0.35

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
SCHEMBL11949396 1.00 BLM (0.52) BLMLMNATSHRPTPN1CA12
SCHEMBL11949388 1.00 BLM (0.52) BLMLMNATSHRPTPN1CA12
SCHEMBL27904910 0.94 BLM (0.47) BLMLMNATSHRPTPN1CA12
SCHEMBL16049088 0.92 TSHR (0.54) BLMLMNATSHRPTPN1CA12
SCHEMBL3577630 0.92 TSHR (0.54) BLMLMNATSHRPTPN1CA12
SCHEMBL17554347 0.92 TSHR (0.54) BLMLMNATSHRPTPN1CA12
SCHEMBL11718137 0.90 LMNA (0.54) BLMLMNATSHRPTPN1CA12
SCHEMBL23673108 0.89 LMNA (0.52) BLMLMNATSHRPTPN1L3MBTL1
SCHEMBL23673152 0.89 LMNA (0.52) BLMLMNATSHRPTPN1L3MBTL1
SCHEMBL23673106 0.86 L3MBTL1 (0.53) BLMLMNATSHRPTPN1L3MBTL1

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-8232431-B2 Specific branched surfactants and consumer products THE PROCTER & GAMBLE COMPANY (US) 2012-07-31 US disclosed
US-20110034363-A1 Specific Branched Surfactants and Consumer Products THE PROCTER & GAMBLE COMPANY 2011-02-10 US disclosed