SCHEMBL239718

SCHEMBL239718

CCCCCCCCCCCCCCCCCCCCCCC(C)C(C)(N)O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.47
FDPS P14324 5/20 0.46
OPRM1 P35372 1/20 0.44
LAP3 P28838 2/20 0.44
LMNA P02545 2/20 0.41
TP53 P04637 1/20 0.41
S1PR2 O95136 5/20 0.40
S1PR1 P21453 5/20 0.40
S1PR3 Q99500 5/20 0.40
S1PR4 O95977 4/20 0.40
GMNN O75496 1/20 0.39
POLB P06746 1/20 0.39
CYP2D6 P10635 1/20 0.39
THPO P40225 1/20 0.39
MTOR P42345 1/20 0.39
BLM P54132 1/20 0.39

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
SCHEMBL1838534 1.00 SPHK1 (0.47) SPHK1FDPSOPRM1LAP3LMNA
SCHEMBL238536 1.00 SPHK1 (0.47) SPHK1FDPSOPRM1LAP3LMNA
SCHEMBL28188933 1.00 SPHK1 (0.47) SPHK1FDPSOPRM1LAP3LMNA
SCHEMBL10944415 1.00 SPHK1 (0.47) SPHK1FDPSOPRM1LAP3LMNA
SCHEMBL17201413 1.00 SPHK1 (0.47) SPHK1FDPSOPRM1LAP3LMNA
SCHEMBL10944412 1.00 SPHK1 (0.47) SPHK1FDPSOPRM1LAP3LMNA
SCHEMBL28359730 1.00 SPHK1 (0.47) SPHK1FDPSOPRM1LAP3LMNA
Water SCHEMBL16398741 0.98 SPHK1 (0.45) SPHK1FDPSOPRM1LAP3LMNA
Hydrochloric Acid SCHEMBL15917465 0.98 SPHK1 (0.45) SPHK1FDPSOPRM1LAP3LMNA
Hydrochloric Acid SCHEMBL28887929 0.98 SPHK1 (0.45) SPHK1FDPSOPRM1LAP3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8728229-B2 Cement slurry composition KAO CORPORATION (JP) 2014-05-20 US disclosed
US-20120000397-A1 CEMENT SLURRY COMPOSITION KAO CORPORATION (JP) 2012-01-05 US disclosed
WO-2010143312-A1 CEMENT SLURRY COMPOSITION KAO CORPORATION (JP) 2010-12-16 WO disclosed