SCHEMBL12475427

SCHEMBL12475427

C[C]C(CCCC)CC(C)C

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.33
OPRM1 P35372 1/20 0.32
SPHK1 Q9NYA1 1/20 0.31
CTSK P43235 1/20 0.31
ALDH1A1 P00352 2/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL12475463 0.82 DNM1 (0.41) DNM1OPRM1ALDH1A1TDP1
SCHEMBL3682428 0.81 TSHR (0.40) DNM1OPRM1CTSKALDH1A1TDP1
SCHEMBL12475544 0.77 DNM1 (0.38) DNM1OPRM1ALDH1A1TDP1
SCHEMBL12475459 0.77
Iodide SCHEMBL553389 0.70 DNM1 (0.45) DNM1OPRM1ALDH1A1TDP1
SCHEMBL671342 0.69 ALDH1A1 (0.46) DNM1OPRM1CTSKALDH1A1TDP1
SCHEMBL597280 0.69 LMNA (0.41) DNM1OPRM1CTSKALDH1A1TDP1
SCHEMBL4654050 0.69 ALDH1A1 (0.46) DNM1OPRM1CTSKALDH1A1TDP1
SCHEMBL12475283 0.69
SCHEMBL3927853 0.68 SPHK1 (0.46) DNM1OPRM1SPHK1CTSKALDH1A1

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-3131965-A1 METHODS OF PREPARING COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF USING SAME Valspar Sourcing, Inc. (US) 2017-02-22 EP disclosed
WO-2015160788-A1 METHODS OF PREPARING COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF USING SAME VALSPAR SOURCING, INC. (US) 2015-10-22 WO disclosed
EP-2673323-A2 COATING COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF COATING Valspar Sourcing, Inc. (US) 2013-12-18 EP disclosed
WO-2012109278-A2 COATING COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF COATING VALSPAR SOURCING, INC. (US) 2012-08-16 WO disclosed