SCHEMBL8010373

SCHEMBL8010373

Bc1cc(C2OCCO2)ccc1O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.38
PTPN1 P18031 2/20 0.38
YWHAG P61981 1/20 0.36
RAB9A P51151 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
CCNB2 O95067 1/20 0.33
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
GSK3B P49841 1/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33
CCNB3 Q8WWL7 1/20 0.33
QDPR P09417 2/20 0.33
HTT P42858 1/20 0.31
CYP3A4 P08684 1/20 0.30
PTGS2 P35354 1/20 0.30

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
SCHEMBL17320655 0.82 ALOX5 (0.55) ALOX5PTPN1YWHAGMEN1KMT2A
SCHEMBL3695981 0.77 ESR1 (0.43) ALOX5PTPN1YWHAGRAB9APPARG
SCHEMBL3691459 0.77 MEN1 (0.40) ALOX5PTPN1YWHAGRAB9AMEN1
SCHEMBL3695721 0.77 HSD17B10 (0.43) ALOX5PTPN1YWHAGCYP3A4
SCHEMBL242386 0.77 DRD3 (0.47) ALOX5PTPN1YWHAGRAB9AMEN1
SCHEMBL1587499 0.77 ALOX15 (0.43) ALOX5PTPN1YWHAGRAB9AMEN1
SCHEMBL26427919 0.73 ACMSD (0.58) ALOX5PTPN1MEN1KMT2AHTT
SCHEMBL3690573 0.73 PPARG (0.64) ALOX5PTPN1MEN1KMT2APPARG
SCHEMBL9423755 0.73 APP (0.40) ALOX5PTPN1YWHAGRAB9AMEN1
SCHEMBL9451016 0.71 MEN1 (0.44) RAB9AMEN1KMT2ACCNB2CDK1

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-2009098287-A1 PHENYL-PRENYL DERIVATIVES, OF MARINE AND SYNTHETIC ORIGIN, FOR THE TREATMENT OF COGNITIVE, NEURODEGENERATIVE OR NEURONAL DISEASES OR DISORDERS NOSCIRA S.A. (ES) 2009-08-13 WO disclosed