SCHEMBL6467404

SCHEMBL6467404

CCCCC(OC(=O)O)c1ccccc1C(=O)OCC

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.51
HSD17B10 Q99714 4/20 0.49
KDM4E B2RXH2 3/20 0.49
ALDH1A1 P00352 9/20 0.49
CYP3A4 P08684 3/20 0.49
CA2 P00918 1/20 0.49
TDP1 Q9NUW8 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MAPK1 P28482 3/20 0.46
TP53 P04637 1/20 0.46
LMNA P02545 2/20 0.45
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
CDC25A P30304 1/20 0.40
CDC25B P30305 1/20 0.40
CDC25C P30307 1/20 0.40
KMT2A Q03164 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
SCHEMBL7036476 0.95 PRSS1 (0.51) TSHRHSD17B10KDM4EALDH1A1CYP3A4
SCHEMBL6467391 0.91 TSHR (0.53) TSHRHSD17B10KDM4EALDH1A1CYP3A4
SCHEMBL6472214 0.88 ALDH1A1 (0.44) TSHRHSD17B10KDM4EALDH1A1CYP3A4
SCHEMBL7644388 0.86 PRSS1 (0.52) TSHRHSD17B10KDM4EALDH1A1CYP3A4
SCHEMBL7036470 0.86 PRSS1 (0.52) TSHRHSD17B10KDM4EALDH1A1CYP3A4
SCHEMBL6436479 0.83 ALDH1A1 (0.51) TSHRHSD17B10KDM4EALDH1A1CYP3A4
SCHEMBL29105832 0.82 TSHR (0.59) TSHRHSD17B10KDM4EALDH1A1CYP3A4
SCHEMBL29105868 0.80 ALDH1A1 (0.56) TSHRHSD17B10KDM4EALDH1A1CYP3A4
SCHEMBL6472205 0.78 CYP1A2 (0.45) TSHRHSD17B10KDM4EALDH1A1CYP3A4
SCHEMBL23544514 0.77 ALDH1A1 (0.50) TSHRKDM4EALDH1A1CYP3A4CA2

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-1191064-B1 AROMATIC POLYCARBONATE COMPOSITION TEIJIN LTD (JP) 2005-12-07 EP disclosed
US-20030195329-A1 Aromatic polycarbonate, composition thereof , and use TEIJIN LIMITED (JP) 2003-10-16 US disclosed
US-6608165-B2 Melt polycondensing a dihydroxy compound and a carbonic acid diester in the presence of an ester exchange catalyst TEIJIN LIMITED (JP) 2003-08-19 US disclosed
US-20030060593-A1 Aromatic polycarbonate and process for their production TEIJIN LIMITED (JP) 2003-03-27 US disclosed
US-6448365-B1 Aromatic polycarbonate composition TEIJIN LIMITED (JP) 2002-09-10 US disclosed
EP-1191064-A1 AROMATIC POLYCARBONATE COMPOSITION TEIJIN LIMITED (JP) 2002-03-27 EP disclosed