SCHEMBL7175331

SCHEMBL7175331

CCCCCCCCCCCCOCOC(C)=O

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.59
ALDH1A1 P00352 2/20 0.56
TSHR P16473 3/20 0.50
NAAA Q02083 1/20 0.50
EPHX1 P07099 1/20 0.47
MEN1 O00255 1/20 0.47
THRB P10828 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPT P10636 1/20 0.47
FAAH O00519 2/20 0.46
DGKA P23743 1/20 0.45
PLA2G2C Q5R387 1/20 0.45
HCAR2 Q8TDS4 1/20 0.43
RAD52 P43351 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL895946 1.00 CES2 (0.59) CES2ALDH1A1TSHRNAAAEPHX1
SCHEMBL18826709 0.98 ALDH1A1 (0.58) CES2ALDH1A1TSHRNAAAEPHX1
SCHEMBL896139 0.91 ALDH1A1 (0.67) CES2ALDH1A1TSHRNAAAFAAH
SCHEMBL3388001 0.91 ALDH1A1 (0.46) CES2ALDH1A1TSHRNAAAEPHX1
SCHEMBL3391150 0.91 ALDH1A1 (0.46) CES2ALDH1A1TSHRNAAAEPHX1
SCHEMBL3391086 0.91 ALDH1A1 (0.46) CES2ALDH1A1TSHRNAAAEPHX1
SCHEMBL3388943 0.91 ALDH1A1 (0.46) CES2ALDH1A1TSHRNAAAEPHX1
SCHEMBL3392629 0.91 ALDH1A1 (0.46) CES2ALDH1A1TSHRNAAAEPHX1
SCHEMBL9192471 0.88 ALDH1A1 (0.61) CES2ALDH1A1TSHRMEN1THRB
SCHEMBL3392552 0.84 ALDH1A1 (0.48) CES2ALDH1A1TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0664321-B1 Polycarbonates stabilized against radiation BAYER AG (DE) 2003-04-16 EP disclosed
EP-0611797-B1 Radiation-resistant polycarbonates BAYER AG (DE) 1998-12-02 EP disclosed
US-5612398-A Radiation-resistant polycarbonates BAYER AG (DE) 1997-03-18 US disclosed
US-5464893-A Aromatic polycarbonates for molding materials and stabilizers BAYER AKTIENGESELLSCHAFT (DE) 1995-11-07 US disclosed
EP-0664321-A1 Polycarbonates stabilized against radiation BAYER AG (DE) 1995-07-26 EP disclosed
EP-0611797-A1 Radiation-resistant polycarbonates BAYER AG (DE) 1994-08-24 EP disclosed