SCHEMBL6237036

SCHEMBL6237036

CCCCCCCCCCCCCCN1CCC(C)(N)[C@@]1(C)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.36
S1PR3 Q99500 2/20 0.36
S1PR5 Q9H228 2/20 0.36
S1PR4 O95977 1/20 0.35
BCHE P06276 1/20 0.35
CPB2 Q96IY4 1/20 0.34
OPRM1 P35372 1/20 0.34
GNAI3 P08754 3/20 0.33
GNAI1 P63096 3/20 0.33
GNAO1 P09471 2/20 0.33
KCNH2 Q12809 1/20 0.33
RARB P10826 1/20 0.32
RARG P13631 1/20 0.32

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
SCHEMBL6229847 1.00 S1PR1 (0.36) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL1645704 0.72 BCHE (0.36) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL15920931 0.72 S1PR1 (0.38) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL1645706 0.72 BCHE (0.36) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL10818617 0.69 L3MBTL1 (0.38) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL10527688 0.69 S1PR1 (0.41) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL28772993 0.69 S1PR1 (0.41) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL454182 0.69 S1PR1 (0.41) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL456427 0.68 S1PR1 (0.40) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL11746132 0.68 FAAH (0.35) S1PR1S1PR3S1PR5S1PR4BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1525475-A2 SENSOR SURFACE COMPRISING AN IMPROVED SIGNAL-NOISE RATIO Micronas Holding GmbH (DE) 2005-04-27 EP claimed
WO-2004017070-A2 SENSOR SURFACE COMPRISING AN IMPROVED SIGNAL-NOISE RATIO MICRONAS HOLDING GMBH (DE) 2004-02-26 WO claimed