SCHEMBL6469976

SCHEMBL6469976

C=C(C)C(=O)OCCOOc1ccc(C(C)(C)c2ccc(OC(=O)C(=C)C)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.42
POLB P06746 3/20 0.40
HTT P42858 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
APEX1 P27695 1/20 0.40
KMT2A Q03164 4/20 0.39
ATM Q13315 1/20 0.39
THRB P10828 1/20 0.38
KDM4E B2RXH2 6/20 0.34
TSHR P16473 2/20 0.34
ALDH1A1 P00352 5/20 0.34
MEN1 O00255 2/20 0.34
AR P10275 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 1/20 0.33
BCHE P06276 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL16806094 0.88 POLB (0.45) ELANEPOLBHTTTDP1APEX1
SCHEMBL65218 0.87 POLB (0.51) ELANEPOLBHTTTDP1APEX1
SCHEMBL6668640 0.85 POLB (0.56) ELANEPOLBHTTTDP1APEX1
SCHEMBL1123797 0.85 ELANE (0.44) ELANEPOLBHTTTDP1APEX1
SCHEMBL6290863 0.84 POLB (0.44) ELANEPOLBHTTTDP1APEX1
SCHEMBL17510055 0.84 POLB (0.48) ELANEPOLBHTTTDP1APEX1
SCHEMBL620722 0.84 POLB (0.48) ELANEPOLBHTTTDP1APEX1
SCHEMBL14173071 0.83 ELANE (0.56) ELANEPOLBHTTTDP1KMT2A
SCHEMBL30971 0.83 ELANE (0.56) ELANEPOLBHTTTDP1KMT2A
SCHEMBL17867710 0.82 POLB (0.50) ELANEPOLBHTTTDP1APEX1

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-20050179149-A1 Mould, a method of manufacturing the same as well as its use KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 2005-08-18 US disclosed
EP-1499487-A1 A MOULD, A METHOD OF MANUFACTURING THE SAME AS WELL AS ITS USE Koninklijke Philips Electronics N.V. (NL) 2005-01-26 EP disclosed
WO-2003084727-A1 A MOULD, A METHOD OF MANUFACTURING THE SAME AS WELL AS ITS USE KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 2003-10-16 WO disclosed