SCHEMBL4954643

SCHEMBL4954643

CCCCCCCCCCCCCCCCCCOC[C]=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.48
HTT P42858 2/20 0.46
MEN1 O00255 1/20 0.46
THRB P10828 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 1/20 0.46
USP2 O75604 1/20 0.45
LPAR5 Q9H1C0 1/20 0.42
ALDH1A1 P00352 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PLA2G2C Q5R387 1/20 0.41
CA1 P00915 5/20 0.40
CA2 P00918 5/20 0.40
CA9 Q16790 5/20 0.40
LPAR1 Q92633 2/20 0.40
LPAR3 Q9UBY5 2/20 0.40
LPAR2 Q9HBW0 1/20 0.40
SPHK1 Q9NYA1 1/20 0.40
NAAA Q02083 1/20 0.40
CA12 O43570 1/20 0.40

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
SCHEMBL9802054 1.00 CES2 (0.48) CES2HTTMEN1THRBKMT2A
SCHEMBL2097337 1.00 CES2 (0.48) CES2HTTMEN1THRBKMT2A
SCHEMBL10702206 1.00 CES2 (0.48) CES2HTTMEN1THRBKMT2A
SCHEMBL10704056 1.00 CES2 (0.48) CES2HTTMEN1THRBKMT2A
SCHEMBL10953427 1.00 CES2 (0.48) CES2HTTMEN1THRBKMT2A
SCHEMBL10704481 1.00 CES2 (0.48) CES2HTTMEN1THRBKMT2A
SCHEMBL173320 0.98
SCHEMBL1145474 0.90
SCHEMBL28057943 0.88 FAAH (0.48) LPAR1LPAR3LPAR2
SCHEMBL23174998 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7344658-B2 Radiation protector and utilization thereof ALLMIGHTY CO., LTD. (JP) 2008-03-18 US disclosed
US-20050087705-A1 Radiation protector and utilization thereof ALLMIGHTY CO., LTD. (JP) 2005-04-28 US disclosed
EP-1475806-A1 RADIATION PROTECTOR AND UTILIZATION THEREOF Allmighty Co., Ltd. (JP) 2004-11-10 EP disclosed