SCHEMBL6056359

SCHEMBL6056359

CCCCCCCCCCCCCCCCCC(C)C(N)C(O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.57
OPRM1 P35372 1/20 0.50
CYP2D6 P10635 2/20 0.48
LMNA P02545 2/20 0.48
TP53 P04637 2/20 0.48
GMNN O75496 1/20 0.48
POLB P06746 1/20 0.48
THPO P40225 1/20 0.48
MTOR P42345 1/20 0.48
BLM P54132 1/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPT P10636 1/20 0.48
CETP P11597 1/20 0.48
HTT P42858 1/20 0.48
UBE2N P61088 1/20 0.48
S1PR2 O95136 5/20 0.44
S1PR1 P21453 5/20 0.44
S1PR3 Q99500 5/20 0.44

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
Hydrochloric Acid SCHEMBL2047075 0.98 SPHK1 (0.55) SPHK1OPRM1CYP2D6LMNATP53
Sulfuric Acid SCHEMBL5183199 0.91 TP53 (0.61) SPHK1OPRM1CYP2D6LMNATP53
SCHEMBL10399681 0.82 SPHK1 (0.61) SPHK1OPRM1CYP2D6LMNATP53
SCHEMBL7155450 0.82 SPHK1 (0.61) SPHK1OPRM1CYP2D6LMNATP53
SCHEMBL19847102 0.82 SPHK1 (0.61) SPHK1OPRM1CYP2D6LMNATP53
SCHEMBL11038534 0.82 SPHK1 (0.61) SPHK1OPRM1CYP2D6LMNATP53
SCHEMBL1313528 0.82 SPHK1 (0.61) SPHK1OPRM1CYP2D6LMNATP53
SCHEMBL9122035 0.81 SPHK1 (0.54) SPHK1OPRM1CYP2D6LMNATP53
SCHEMBL272182 0.81 SPHK1 (0.54) SPHK1OPRM1CYP2D6LMNATP53
SCHEMBL29116527 0.81 SPHK1 (0.54) SPHK1OPRM1CYP2D6LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2729552-B1 FIRE-RESISTANT CELLULOSIC MATERIAL NAT RES COUNCIL CANADA (CA) 2018-03-21 EP disclosed
US-9175147-B2 Fire-resistant cellulosic material NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2015-11-03 US disclosed
EP-2729552-A1 FIRE-RESISTANT CELLULOSIC MATERIAL National Research Council of Canada (CA) 2014-05-14 EP disclosed
US-20140121306-A1 Fire-Resistant Cellulosic Material NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2014-05-01 US disclosed
WO-2013003944-A1 FIRE-RESISTANT CELLULOSIC MATERIAL NATIONAL RESEARCH COUNSIL OF CANADA (CA) 2013-01-10 WO disclosed
WO-2006066392-A1 INTERCALATION AND FUNCTIONALIZATION OF NANOPARTICLES NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2006-06-29 WO disclosed