SCHEMBL2493818

SCHEMBL2493818

Cc1cc(C(=O)O)ccc1C(=O)OCC1CO1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.42
MGLL Q99685 2/20 0.41
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL1376714 0.91 DHFR (0.43) DHFRMGLLNPC1ALDH1A1KMT2A
SCHEMBL4887674 0.90 DHFR (0.43) DHFRMGLL
SCHEMBL679935 0.89 KDM4E (0.43) DHFRMGLL
SCHEMBL1144451 0.89 DHFR (0.42) DHFRMGLL
SCHEMBL8766571 0.85 DHFR (0.40) DHFRMGLL
Ether SCHEMBL2787072 0.84 DHFR (0.38) DHFRMGLLNPC1MEN1KMT2A
SCHEMBL27669935 0.84 ALDH1A1 (0.42) DHFRMGLLALDH1A1
SCHEMBL1714542 0.83 ALDH1A1 (0.47) DHFRMGLLALDH1A1
SCHEMBL22357191 0.83 ALDH1A1 (0.47) DHFRMGLLALDH1A1
SCHEMBL12177586 0.83 DHFR (0.42) DHFRMGLLNPC1ALDH1A1KMT2A

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
CN-105829482-A Adhesive composition, adhesive layer, adhesive tape, and double-sided adhesive tape 日东电工株式会社 2016-08-03 CN disclosed
US-8030382-B2 Polylactic acid composition TEIJIN LIMITED (JP) 2011-10-04 US disclosed
US-20100093888-A1 POLYLACTIC ACID COMPOSITION TEIJIN LIMITED (JP) 2010-04-15 US disclosed
EP-2116576-A1 POLYLACTIC ACID COMPOSITION Teijin Limited (JP) 2009-11-11 EP disclosed