SCHEMBL8437732

SCHEMBL8437732

CCCCCCCCCCCCC1(O)C=CC(O)=CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 2/20 0.35
DNTT P04053 1/20 0.35
POLB P06746 1/20 0.35
PTPN1 P18031 2/20 0.32
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
OPRK1 P41145 1/20 0.32
OPRL1 P41146 1/20 0.32
GAA P10253 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
ESR1 P03372 2/20 0.30
ADRA2A P08913 2/20 0.30
ADORA3 P0DMS8 2/20 0.30
TACR2 P21452 2/20 0.30
SLC6A2 P23975 2/20 0.30
SLC6A4 P31645 2/20 0.30
SLC6A3 Q01959 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL8436810 1.00 POLA1 (0.35) POLA1DNTTPOLBPTPN1OPRM1
SCHEMBL5803999 1.00 POLA1 (0.35) POLA1DNTTPOLBPTPN1OPRM1
SCHEMBL8433691 1.00 POLA1 (0.35) POLA1DNTTPOLBPTPN1OPRM1
SCHEMBL27389195 0.86
SCHEMBL11415772 0.82 DNTT (0.34) POLA1DNTTPOLBOPRM1OPRD1
SCHEMBL27885764 0.82 DNTT (0.34) POLA1DNTTPOLBOPRM1OPRD1
SCHEMBL10450060 0.82 DNTT (0.34) POLA1DNTTPOLBOPRM1OPRD1
SCHEMBL28888351 0.80 DNTT (0.32) POLA1DNTTPOLBGAACNR1
SCHEMBL31279666 0.80 DNTT (0.32) POLA1DNTTPOLBGAACNR1
SCHEMBL11520528 0.80 DNTT (0.32) POLA1DNTTPOLBGAACNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE36139-E ANTIOXIDANTS FOR FOODS, COSMETICS; ANTITUMOR AGENTS NIPPON HYPOX LABORATORIES INCORPORATED (JP) 1999-03-09 US disclosed
US-5416242-A Compounds for oxidation resistance NIPPON HYPOX LABORATORIES INCORPORATED (JP) 1995-05-16 US disclosed
EP-0589069-A1 Hydroquinone derivatives and antioxidants and tumor inhibitors containing them NIPPON HYPOX LABORATORIES INCORPORATED (JP) 1994-03-30 EP disclosed