SCHEMBL19944064

SCHEMBL19944064

C/C(=C\CCC(=O)OCC(C)CCCC(C)O)CCCC(C)CCCC(C)CCCC(C)C

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.56
KDM1A O60341 1/20 0.49
PTPN2 P17706 1/20 0.47
CDC25B P30305 1/20 0.47
PTGS1 P23219 1/20 0.39
PDE4A P27815 1/20 0.39
SNCA P37840 1/20 0.39
PDE3A Q14432 1/20 0.39
PSEN1 P49768 2/20 0.35
BLM P54132 1/20 0.35
MAPT P10636 1/20 0.35
GLRA3 O75311 2/20 0.34
TRPV1 Q8NER1 1/20 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
SCHEMBL23730473 0.92 PTPN1 (0.59) PTPN1KDM1APTPN2CDC25BPTGS1
SCHEMBL23730478 0.92 PTPN1 (0.59) PTPN1KDM1APTPN2CDC25BPTGS1
SCHEMBL23730359 0.89 PTPN1 (0.58) PTPN1KDM1APTPN2CDC25BPTGS1
SCHEMBL28909249 0.89 PTPN1 (0.58) PTPN1KDM1APTPN2CDC25BPTGS1
SCHEMBL13277667 0.86 PTPN1 (0.55) PTPN1KDM1APTPN2CDC25BPTGS1
SCHEMBL13277409 0.86 PTPN1 (0.55) PTPN1KDM1APTPN2CDC25BPTGS1
SCHEMBL23960224 0.86 PTPN1 (0.55) PTPN1KDM1APTPN2CDC25BPTGS1
SCHEMBL12633729 0.86 PTPN1 (0.55) PTPN1KDM1APTPN2CDC25BPTGS1
SCHEMBL13277820 0.85 PTPN1 (0.54) PTPN1KDM1APTPN2CDC25BPTGS1
SCHEMBL13277823 0.85 PTPN1 (0.54) PTPN1KDM1APTPN2CDC25BPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018043731-A1 ANTI-ADHESION AGENT USING EMULSION THAT CONTAINS OIL COMPONENT 株式会社ファルネックス 2018-03-08 WO disclosed