SCHEMBL609968

SCHEMBL609968

O=C(C=Cc1ccc(O)cc1)C=C(O)C=Cc1ccc(O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 8/20 1.00
BACE1 P56817 8/20 1.00
TLR9 Q9NR96 1/20 1.00
F3 P13726 4/20 0.73
TYR P14679 3/20 0.73
CYP2D6 P10635 2/20 0.73
CYP2C9 P11712 2/20 0.73
HSD11B1 P28845 1/20 0.73
FOS P01100 1/20 0.70
JUN P05412 1/20 0.70
AKR1B10 O60218 2/20 0.64
AKR1B1 P15121 2/20 0.64
PKM P14618 2/20 0.64
CA12 O43570 2/20 0.64
CA1 P00915 2/20 0.64
CA2 P00918 2/20 0.64
CA7 P43166 2/20 0.64
CA9 Q16790 2/20 0.64
CA14 Q9ULX7 2/20 0.64
ESR1 P03372 1/20 0.64

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
SCHEMBL609967 1.00 GSK3B (1.00) GSK3BBACE1TLR9F3TYR
SCHEMBL13311574 0.94 GSK3B (0.89) GSK3BBACE1TLR9F3TYR
SCHEMBL15290855 0.91 FOS (0.87) GSK3BBACE1TLR9F3TYR
SCHEMBL3825969 0.86 GSK3B (0.75) GSK3BBACE1TLR9F3TYR
SCHEMBL3825974 0.86 GSK3B (0.75) GSK3BBACE1TLR9F3TYR
SCHEMBL3825972 0.86 GSK3B (0.75) GSK3BBACE1TLR9F3TYR
SCHEMBL3580956 0.85 TYR (1.00) GSK3BBACE1TLR9F3TYR
SCHEMBL2198475 0.85 TYR (1.00) GSK3BBACE1TLR9F3TYR
SCHEMBL2146080 0.85 TYR (1.00) GSK3BBACE1TLR9F3TYR
SCHEMBL23260255 0.85 GSK3B (0.73) GSK3BBACE1TLR9F3TYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11596716-B2 Compounds and matrices for use in bone growth and repair HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2023-03-07 US disclosed
US-20210138117-A1 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2021-05-13 US disclosed
US-10874766-B2 Compounds and matrices for use in bone growth and repair HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2020-12-29 US disclosed
EP-3038621-B1 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR HUMAN BIOMOLECULAR RES INSTITUTE (US) 2020-12-02 EP disclosed
US-20160038641-A1 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2016-02-11 US disclosed
US-20120040976-A1 SMALL MOLECULE IMMUNOMODULATORS FOR ALZHEIMER'S DISEASE HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2012-02-16 US disclosed
WO-2010068935-A2 SMALL MOLECULE IMMUNOMODULATORS FOR ALZHEIMER'S DISEASE HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2010-06-17 WO disclosed
US-20090263492-A1 Diagnostic Methods and Genetic Markers for Alzheimer Disease HUMAN BIOMOLECULAR RESEARCH INSTITUTE 2009-10-22 US disclosed
WO-2008048410-A9 DIAGNOSTIC METHODS AND GENETIC MARKERS FOR ALZHEIMER DISEASE HUMAN BIOMOLECULAR RES INST (US) 2008-06-26 WO disclosed
WO-2008048410-A2 DIAGNOSTIC METHODS AND GENETIC MARKERS FOR ALZHEIMER DISEASE HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2008-04-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10874766-B2 Compounds and matrices for use in bone growth and repair BMP2, BMP4, BMP6 GSK3B 920/4885BACE1 1942/4885TLR9 2057/4885
US-11596716-B2 Compounds and matrices for use in bone growth and repair BMP2, BMP4, BMP6 GSK3B 918/4885BACE1 2083/4885TLR9 2565/4885
US-20090263492-A1 Diagnostic Methods and Genetic Markers for Alzheimer Disease CHAT, SLC18A3, GAP43 GSK3B 2770/4885BACE1 60/4885TLR9 4199/4885
US-20210138117-A1 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR BMP2, BMP4, BMP6 GSK3B 918/4885BACE1 2083/4885TLR9 2565/4885
US-20160038641-A1 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR BMP2, BMP4, BMP6 GSK3B 998/4885BACE1 2700/4885TLR9 1928/4885
US-20120040976-A1 SMALL MOLECULE IMMUNOMODULATORS FOR ALZHEIMER'S DISEASE L1CAM, LY96, GMFG GSK3B 3394/4885BACE1 435/4885TLR9 280/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.