SCHEMBL13730862

SCHEMBL13730862

CCCCCCCCC[C@](N)(O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.41
SPHK1 Q9NYA1 2/20 0.41
LMNA P02545 2/20 0.41
GMNN O75496 1/20 0.41
POLB P06746 1/20 0.41
THPO P40225 1/20 0.41
MTOR P42345 1/20 0.41
BLM P54132 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
CETP P11597 1/20 0.41
HTT P42858 1/20 0.41
UBE2N P61088 1/20 0.41
SMPD1 P17405 4/20 0.38
FDPS P14324 3/20 0.37
TNNC1 P63316 5/20 0.35
S1PR4 O95977 2/20 0.35

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
SCHEMBL28367467 0.95 CYP2D6 (0.40) CYP2D6SPHK1LMNAGMNNPOLB
SCHEMBL28367954 0.95 CYP2D6 (0.40) CYP2D6SPHK1LMNAGMNNPOLB
SCHEMBL28364087 0.88 LMNA (0.39) CYP2D6SPHK1LMNAGMNNPOLB
SCHEMBL15675970 0.83 TRPV1 (0.33) CYP2D6SPHK1LMNAGMNNPOLB
SCHEMBL30544748 0.81 LMNA (0.38) CYP2D6SPHK1LMNAGMNNPOLB
SCHEMBL29521151 0.81 LMNA (0.38) CYP2D6SPHK1LMNAGMNNPOLB
SCHEMBL13729991 0.80 USP2 (0.45) CYP2D6SPHK1LMNAGMNNPOLB
SCHEMBL21694053 0.79 LMNA (0.41) CYP2D6SPHK1LMNAGMNNPOLB
SCHEMBL28364128 0.78 CYP2D6 (0.37) CYP2D6SPHK1LMNAGMNNPOLB
SCHEMBL30203533 0.77 LMNA (0.39) CYP2D6SPHK1LMNAGMNNPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140131258-A1 METHOD FOR REMOVING OIL OrganoPetroleum PSP AB (SE) 2014-05-15 US claimed
EP-2702128-A1 METHOD FOR REMOVING OIL Organopetroleum Psp AB (SE) 2014-03-05 EP claimed
WO-2012146607-A1 METHODS AND COMPOSITIONS FOR ENHANCED OIL RECOVERY OrganoPetroleum PSP AB (SE) 2012-11-01 WO claimed
WO-2012146596-A1 METHOD FOR REMOVING OIL OrganoPetroleum PSP AB (SE) 2012-11-01 WO claimed
US-20140131258-A1 METHOD FOR REMOVING OIL OrganoPetroleum PSP AB (SE) 2014-05-15 US disclosed
EP-2702128-A1 METHOD FOR REMOVING OIL Organopetroleum Psp AB (SE) 2014-03-05 EP disclosed
WO-2012146607-A1 METHODS AND COMPOSITIONS FOR ENHANCED OIL RECOVERY OrganoPetroleum PSP AB (SE) 2012-11-01 WO disclosed
WO-2012146596-A1 METHOD FOR REMOVING OIL OrganoPetroleum PSP AB (SE) 2012-11-01 WO disclosed