SCHEMBL2707013

SCHEMBL2707013

C=C(C)C(=O)OCC.Oc1ccc(C=CC=Cc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.51
CA7 P43166 2/20 0.51
CA9 Q16790 2/20 0.51
CA14 Q9ULX7 2/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
LMNA P02545 2/20 0.50
RAB9A P51151 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
NPC1 O15118 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 4/20 0.49
KDM4E B2RXH2 2/20 0.49
CTDSP1 Q9GZU7 1/20 0.46
NR1H4 Q96RI1 1/20 0.45
AKR1B10 O60218 2/20 0.45
AKR1B1 P15121 2/20 0.45
CA4 P22748 1/20 0.45

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
SCHEMBL2707793 0.90 LMNA (0.48) LMNARAB9AL3MBTL1MEN1KMT2A
SCHEMBL6333117 0.89 THRB (0.55) CA12CA7CA9CA14CA1
SCHEMBL2706129 0.88 ALDH1A1 (0.52) CA12CA7CA9CA14CA1
SCHEMBL2706128 0.88 ALDH1A1 (0.52) CA12CA7CA9CA14CA1
Juarezic Acid SCHEMBL28729155 0.86 RAB9A (0.50) LMNARAB9AL3MBTL1MEN1KMT2A
SCHEMBL1860184 0.86 LMNA (0.50) CA12CA9CA1LMNARAB9A
Coumaric Acid SCHEMBL5145297 0.85 CA12 (0.60) CA12CA7CA9CA14CA1
SCHEMBL2708790 0.85 ABCG2 (0.49) CA12CA7CA9CA14CA1
Phenol SCHEMBL6136311 0.84 ALDH1A1 (0.56) CA12CA7CA9CA14CA1
Phenol SCHEMBL6751269 0.84 ALDH1A1 (0.56) CA12CA7CA9CA14CA1

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
EP-2447291-B1 HIGH-MOLECULAR-WEIGHT COPOLYMER NIPPON SODA CO (JP) 2015-04-08 EP disclosed
US-8729187-B2 High-molecular-weight copolymer NIPPON SODA CO., LTD. (JP) 2014-05-20 US disclosed
US-20120123076-A1 HIGH-MOLECULAR-WEIGHT COPOLYMER NIPPON SODA CO., LTD (JP) 2012-05-17 US disclosed
EP-2447291-A1 HIGH-MOLECULAR-WEIGHT COPOLYMER Nippon Soda Co., Ltd. (JP) 2012-05-02 EP disclosed