SCHEMBL6533666

SCHEMBL6533666

O=C(O)C(O)(CC(O)CO)C(O)C(O)C(O)C(O)C(O)C(O)CCCCCCCCCCO

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACLY P53396 3/20 0.32
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31
HSPD1 P10809 1/20 0.30
BLM P54132 1/20 0.30
HSPE1 P61604 1/20 0.30
PTPN1 P18031 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
SCHEMBL27181873 1.00 ACLY (0.32) ACLYACACBACACAHSPD1BLM
SCHEMBL3430764 1.00 ACLY (0.32) ACLYACACBACACAHSPD1BLM
SCHEMBL706623 0.94 ACLY (0.33) ACLYACACBACACAHSPD1BLM
SCHEMBL29786808 0.76 PDE4A (0.41) ACLY
SCHEMBL17889062 0.70 PDE4A (0.55) PTPN1
SCHEMBL5168154 0.70 PDE4A (0.55) PTPN1
SCHEMBL436281 0.70 PDE4A (0.55) PTPN1
SCHEMBL28380507 0.70 PDE4A (0.55) PTPN1
SCHEMBL28496980 0.70 PDE4A (0.55) PTPN1
SCHEMBL28465166 0.68 PDE4A (0.53) PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6893648-B2 Composition and method for treatment of vaginal dryness MERMELSTEIN HAROLD (US) 2005-05-17 US claimed
US-20030170325-A1 Composition and method for treatment of vaginal dryness MERMELSTEIN HAROLD (US) 2003-09-11 US claimed
US-6893648-B2 Composition and method for treatment of vaginal dryness MERMELSTEIN HAROLD (US) 2005-05-17 US disclosed
US-20030170325-A1 Composition and method for treatment of vaginal dryness MERMELSTEIN HAROLD (US) 2003-09-11 US disclosed