SCHEMBL2124304

SCHEMBL2124304

CCCC#CC(=O)CCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 5/20 0.44
CES2 O00748 4/20 0.44
ALDH1A1 P00352 3/20 0.41
TP53 P04637 1/20 0.41
PTPN7 P35236 5/20 0.41
HMGCR P04035 3/20 0.41
CA1 P00915 1/20 0.39
RECQL P46063 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
ALOX12 P18054 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
MCL1 Q07820 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL12003514 0.91 HMGCR (0.47) CES1CES2ALDH1A1TP53PTPN7
SCHEMBL2124360 0.86 CES2 (0.39) CES1CES2ALDH1A1PTPN7HMGCR
SCHEMBL15456677 0.84 PTPN7 (0.59) CES1CES2ALDH1A1PTPN7HMGCR
SCHEMBL2124601 0.83 CES1 (0.55) CES1CES2ALDH1A1TP53CA1
SCHEMBL2124511 0.83 PTPN7 (0.62) CES1CES2ALDH1A1PTPN7HMGCR
SCHEMBL2121988 0.83 PTPN7 (0.62) CES1CES2ALDH1A1PTPN7HMGCR
SCHEMBL30011879 0.83 PTPN7 (0.62) CES1CES2ALDH1A1PTPN7HMGCR
SCHEMBL997133 0.82 HMGCR (0.47) CES1CES2ALDH1A1PTPN7HMGCR
SCHEMBL28693532 0.81 PTPN7 (0.55) CES1CES2ALDH1A1PTPN7HMGCR
SCHEMBL16939030 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2442783-B1 NOVEL DEODORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME ROBERTET SA (FR) 2017-08-09 EP claimed
US-9265852-B2 Deordorising compositions and deodorising products containing same ROBERTET S.A. (FR) 2016-02-23 US claimed
US-20120201778-A1 NOVEL DEORDORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME ROBERTET S.A. (FR) 2012-08-09 US claimed
EP-2442783-A2 NOVEL DEODORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME Robertet S.A. (FR) 2012-04-25 EP claimed
WO-2010146258-A2 NOVEL DEODORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME ROBERTET S.A. (FR) 2010-12-23 WO claimed
EP-2442783-B1 NOVEL DEODORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME ROBERTET SA (FR) 2017-08-09 EP disclosed
US-9265852-B2 Deordorising compositions and deodorising products containing same ROBERTET S.A. (FR) 2016-02-23 US disclosed
US-20120201778-A1 NOVEL DEORDORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME ROBERTET S.A. (FR) 2012-08-09 US disclosed
EP-2442783-A2 NOVEL DEODORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME Robertet S.A. (FR) 2012-04-25 EP disclosed
WO-2010146258-A2 NOVEL DEODORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME ROBERTET S.A. (FR) 2010-12-23 WO disclosed