SCHEMBL3204345

SCHEMBL3204345

C=COC(CC)COCC(=O)O

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.34
TSHR P16473 2/20 0.33
EPHX2 P34913 1/20 0.32
CTSK P43235 2/20 0.32
TLR2 O60603 1/20 0.31
PAM P19021 2/20 0.31
ALDH1A1 P00352 1/20 0.30
CTSL P07711 1/20 0.30
CTSB P07858 1/20 0.30
GLA P06280 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL25612553 0.79 PAM (0.33) PTGS1TSHREPHX2TLR2PAM
Propene SCHEMBL27971597 0.78 FFAR1 (0.38) PTGS1TSHRALDH1A1GLAL3MBTL1
SCHEMBL587060 0.76 ALDH1A1 (0.38) TSHRPAMALDH1A1
SCHEMBL16318716 0.76 TSHR (0.39) TSHRALDH1A1
SCHEMBL25612561 0.76 PTGS1 (0.32) PTGS1TSHRTLR2PAMALDH1A1
SCHEMBL33527909 0.74 TSHR (0.55) TSHRALDH1A1
SCHEMBL3344644 0.74 FFAR1 (0.42) PTGS1TSHRALDH1A1GLAL3MBTL1
SCHEMBL6470476 0.74 ALDH1A1 (0.43) TSHRTLR2PAMALDH1A1
SCHEMBL4605926 0.72
SCHEMBL3162735 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7682651-B2 Method for manufacturing display device CANON KABUSHIKI KAISHA (JP) 2010-03-23 US disclosed
US-20050231795-A1 Method for manufacturing display device CANON KABUSHIKI KAISHA (JP) 2005-10-20 US disclosed