SCHEMBL3629434

SCHEMBL3629434

CCCCOC(=O)NCCCCCCCC(=O)O

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.76
ACHE P22303 14/20 0.69
PLA2G2A P14555 1/20 0.57
ADRA1A P35348 1/20 0.53
EPHX1 P07099 1/20 0.53

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
SCHEMBL3625938 1.00 EPHX2 (0.76) EPHX2ACHEPLA2G2AADRA1AEPHX1
SCHEMBL1077924 1.00 EPHX2 (0.76) EPHX2ACHEPLA2G2AADRA1AEPHX1
SCHEMBL19400416 1.00 EPHX2 (0.76) EPHX2ACHEPLA2G2AADRA1AEPHX1
SCHEMBL19400387 1.00 EPHX2 (0.76) EPHX2ACHEPLA2G2AADRA1AEPHX1
SCHEMBL19400357 1.00 EPHX2 (0.76) EPHX2ACHEPLA2G2AADRA1AEPHX1
SCHEMBL19400363 1.00 EPHX2 (0.76) EPHX2ACHEPLA2G2AADRA1AEPHX1
SCHEMBL3655324 0.98 EPHX2 (0.74) EPHX2ACHEPLA2G2A
SCHEMBL8920145 0.95 EPHX2 (0.84) EPHX2ACHEPLA2G2AEPHX1
SCHEMBL9190902 0.95 EPHX2 (0.84) EPHX2ACHEPLA2G2AEPHX1
SCHEMBL9830221 0.95 EPHX2 (0.84) EPHX2ACHEPLA2G2AEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017163808-A1 COMPOUND OR SALT THEREOF, NATURAL KILLER T CELL ACTIVATOR, AND PHARMACEUTICAL COMPOSITION 学校法人慶應義塾 2017-09-28 WO disclosed
EP-2200439-A1 HDAC INHIBITORS Lixte Biotechnology, Inc. (US) 2010-06-30 EP disclosed
WO-2009045440-A1 HDAC INHIBITORS LIXTE BIOTECHNOLOGY HOLDINGS, INC. (US) 2009-04-09 WO disclosed
EP-1745044-A2 BENZOTHIAZOLE DERIVATIVES HAVING CDK MODULATING ACTIVITY AND USE THEREOF AS ANTICANCER AGENTS Aventis Pharma S.A. (FR) 2007-01-24 EP disclosed
WO-2005097787-A2 NOVEL BENZOTHIAZOLES AND THE USE THEREOF AS MEDICAMENTS AVENTIS PHARMA S.A. (FR) 2005-10-20 WO disclosed