SCHEMBL11330737

SCHEMBL11330737

C=C(C)C(=O)OCCC(CCOC(=O)C(=C)C)(C(=O)O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.50
TSHR P16473 3/20 0.48
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 2/20 0.39
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL15194157 0.88 THRB (0.47) THRBTSHRPOLBAPEX1HTT
SCHEMBL7625934 0.82 THRB (0.48) THRBTSHRPOLBAPEX1HTT
SCHEMBL26979799 0.82 THRB (0.48) THRBTSHRPOLBAPEX1HTT
SCHEMBL18492454 0.82 THRB (0.48) THRBTSHRPOLBAPEX1HTT
SCHEMBL26002227 0.81 THRB (0.55) THRBTSHRPOLBAPEX1HTT
SCHEMBL15194578 0.81 THRB (0.47) THRBTSHRPOLBAPEX1HTT
Ammonia Solution, Strong SCHEMBL18492403 0.81 THRB (0.47) THRBTSHRPOLBAPEX1HTT
Methacrylic Acid SCHEMBL28665407 0.81 THRB (0.47) THRBTSHRPOLBAPEX1HTT
Ammonia Solution, Strong SCHEMBL19133680 0.81 THRB (0.47) THRBTSHRPOLBAPEX1HTT
SCHEMBL15194709 0.79 THRB (0.50) THRBTSHRPOLBAPEX1HTT

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-4299895-A Photographic elements containing polymers which coordinate with metal ions EASTMAN KODAK COMPANY (US) 1981-11-10 US disclosed
US-4239847-A Photographic elements containing polymers which coordinate with metal ions EASTMAN KODAK COMPANY (US) 1980-12-16 US disclosed
US-4230456-A QUANTITATIVE ANALYSIS, COMPLEXING EASTMAN KODAK COMPANY (US) 1980-10-28 US disclosed