SCHEMBL17276013

SCHEMBL17276013

CCCCCCCCCCC(N=[N+]=[N-])OC=O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SGPL1 O95470 8/20 0.42
▸ LAP3 P28838 2/20 0.37
▸ ADH1B P00325 1/20 0.37
▸ ADH1C P00326 1/20 0.37
▸ ADH1A P07327 1/20 0.37
▸ ADH4 P08319 1/20 0.37
▸ ADH7 P40394 1/20 0.37
▸ SMPD1 P17405 3/20 0.36
▸ FDPS P14324 3/20 0.35
▸ S1PR2 O95136 3/20 0.34
▸ S1PR1 P21453 3/20 0.34
▸ S1PR3 Q99500 3/20 0.34
▸ S1PR4 O95977 2/20 0.34

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
SCHEMBL25693415 0.75 ADH1B (0.45) ADH1BADH1CADH1AADH4ADH7
SCHEMBL17040070 0.75 ADH1B (0.45) ADH1BADH1CADH1AADH4ADH7
SCHEMBL1614822 0.75 ADH1B (0.45) ADH1BADH1CADH1AADH4ADH7
SCHEMBL17123651 0.75 ADH1B (0.45) ADH1BADH1CADH1AADH4ADH7
SCHEMBL25787303 0.75 ADH1B (0.45) ADH1BADH1CADH1AADH4ADH7
SCHEMBL24654117 0.75 ADH1B (0.45) ADH1BADH1CADH1AADH4ADH7
SCHEMBL18188028 0.75 ADH1B (0.45) ADH1BADH1CADH1AADH4ADH7
SCHEMBL17040069 0.75 ADH1B (0.45) ADH1BADH1CADH1AADH4ADH7
SCHEMBL18782878 0.75 ADH1B (0.45) ADH1BADH1CADH1AADH4ADH7
SCHEMBL20328385 0.75 ADH1B (0.45) ADH1BADH1CADH1AADH4ADH7

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-3145984-A1 THERAPEUTIC CONJUGATES WITH SULFATED DENDRIMERS FOR INTRACELLULAR TARGETING IC Discovery GmbH (DE) 2017-03-29 — — EP disclosed
WO-2015177279-A1 THERAPEUTIC CONJUGATES WITH SULFATED DENDRIMERS FOR INTRACELLULAR TARGETING IC DISCOVERY GMBH (DE) 2015-11-26 — — WO disclosed
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