SCHEMBL9356355

SCHEMBL9356355

CC(=CCc1ccc(O)c(O)c1O)CCCC(C)CCCC(C)CCCC(C)C

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.52
PTGS1 P23219 1/20 0.51
PDE4A P27815 1/20 0.51
SNCA P37840 1/20 0.51
PDE3A Q14432 1/20 0.51
TRPV1 Q8NER1 1/20 0.42
PTPN2 P17706 1/20 0.36
CDC25B P30305 1/20 0.36
PSEN1 P49768 1/20 0.36
KDM1A O60341 1/20 0.36
ALOX15 P16050 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
SCHEMBL9356363 1.00 PTPN1 (0.52) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL9356468 0.88 PTGS1 (0.53) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL9356461 0.88 PTGS1 (0.53) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL16435130 0.83 PTPN1 (0.51) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL9356348 0.83 PTPN1 (0.51) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL9356354 0.83 PTPN1 (0.51) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL24074922 0.83 PTGS1 (0.58) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL1269133 0.80 PTPN1 (0.50) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL1269129 0.80 PTPN1 (0.50) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL31312522 0.79 PTGS1 (0.52) PTPN1PTGS1PDE4ASNCAPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0304842-B1 Isoprenoid derivatives and anti-ulcer agents containing the same NISSHIN FLOUR MILLING CO (JP) 1994-11-30 EP claimed
EP-0304842-A2 Isoprenoid derivatives and anti-ulcer agents containing the same NISSHIN FLOUR MILLING CO., LTD. (JP) 1989-03-01 EP claimed
EP-0304842-B1 Isoprenoid derivatives and anti-ulcer agents containing the same NISSHIN FLOUR MILLING CO (JP) 1994-11-30 EP disclosed
US-4906669-A Isoprenoid derivatives and anti-ulcer agents containing the same NISSHIN FLOUR MILLING CO., LTD. (JP) 1990-03-06 US disclosed
EP-0304842-A2 Isoprenoid derivatives and anti-ulcer agents containing the same NISSHIN FLOUR MILLING CO., LTD. (JP) 1989-03-01 EP disclosed