SCHEMBL15577136

SCHEMBL15577136

CCCCCCC(OC(=O)CCC(=O)OC(CCCCCC)C(CC)Cc1ccccc1)C(CC)Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.46
ACE P12821 1/20 0.43
ALDH1A1 P00352 1/20 0.42
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
CTSK P43235 1/20 0.42
CNR2 P34972 1/20 0.42
MMP2 P08253 11/20 0.42
MMP3 P08254 8/20 0.42
MMP1 P03956 7/20 0.42
MMP7 P09237 6/20 0.42
BIRC2 Q13490 1/20 0.42

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
SCHEMBL15578483 0.84 CTSK (0.46) CSNK1EACEALDH1A1CTSLCTSB
SCHEMBL16670057 0.84 CTSK (0.48) CSNK1EACEALDH1A1CTSLCTSB
SCHEMBL16670058 0.81 CTSK (0.46) ACECTSLCTSBCTSKCNR2
SCHEMBL8916933 0.81 CTSK (0.47) ACECTSLCTSBCTSKCNR2
SCHEMBL15577075 0.80 CTSK (0.42) CSNK1EACECTSLCTSBCTSK
SCHEMBL29128599 0.79 FFAR4 (0.47) ALDH1A1
SCHEMBL11569324 0.79 FOLH1 (0.38) CSNK1EALDH1A1CTSLCTSBCTSK
SCHEMBL5160220 0.78 CTSK (0.45) ACECTSLCTSBCTSKCNR2
SCHEMBL1681593 0.77 MAPK1 (0.53) CSNK1EALDH1A1CTSLCTSBCTSK
SCHEMBL31212516 0.77 LMNA (0.58) ALDH1A1

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
EP-2890671-B1 PLASTICIZERS BASED ON MIXED ESTERS OF SUCCINATE PROVIRON HOLDING N V (BE) 2019-02-06 EP disclosed
US-9359487-B2 Plasticizers based on mixed esters of succinate PROVIRON HOLDING N.V. (BE) 2016-06-07 US disclosed
US-20150225537-A1 PLASTICIZERS BASED ON MIXED ESTERS OF SUCCINATE PROVIRON HOLDING N.V. (BE) 2015-08-13 US disclosed
EP-2890671-A1 PLASTICIZERS BASED ON MIXED ESTERS OF SUCCINATE Proviron Holding N.V. (BE) 2015-07-08 EP disclosed
WO-2014040146-A1 PLASTICIZERS BASED ON MIXED ESTERS OF SUCCINATE PROVIRON HOLDING N.V. (BE) 2014-03-20 WO disclosed