SCHEMBL4940438

SCHEMBL4940438

C=C(CCCCOC(=O)CCl)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.34
NAAA Q02083 1/20 0.33
DGKA P23743 1/20 0.33
TSHR P16473 3/20 0.31
ALDH1A1 P00352 2/20 0.31
CYP3A4 P08684 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
HTR2C P28335 1/20 0.31
EPHX2 P34913 7/20 0.31

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
SCHEMBL4942897 0.94 TBXAS1 (0.32) TBXAS1NAAADGKA
SCHEMBL11342312 0.86 TSHR (0.31) TSHR
SCHEMBL1245604 0.81 DGKA (0.33) TBXAS1DGKAHTR2C
SCHEMBL29291284 0.81 TBXAS1 (0.36) TBXAS1TSHRALDH1A1CYP3A4
SCHEMBL2577539 0.79 NAAA (0.46) NAAADGKATSHRALDH1A1CYP3A4
SCHEMBL301045 0.79 MGAM (0.38) TBXAS1NAAADGKATSHRALDH1A1
SCHEMBL10426042 0.77 DGKA (0.65) NAAADGKATSHRALDH1A1PRSS1
SCHEMBL1989464 0.77 TBXAS1 (0.32) TBXAS1NAAADGKAPRSS1PRSS2
SCHEMBL195758 0.77 FAAH (0.39) TBXAS1NAAADGKATSHRALDH1A1
SCHEMBL3684667 0.77 NAAA (0.50) NAAADGKATSHRALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8609753-B2 Acrylic rubber composition and cross-linked rubber product ZEON CORPORATION (JP) 2013-12-17 US disclosed
US-20120302674-A1 ACRYLIC RUBBER COMPOSITION AND CROSS-LINKED RUBBER PRODUCT ZEON CORPORATION (JP) 2012-11-29 US disclosed
US-20080071014-A1 Acrylic Rubber Composition And Acrylic Rubber Vulcanizate ZEON CORPORATION (JP) 2008-03-20 US disclosed
EP-1790689-A1 ACRYLIC RUBBER COMPOSITION AND ACRYLIC RUBBER CROSSLINKED PRODUCT ZEON CORPORATION (JP) 2007-05-30 EP disclosed