SCHEMBL9639072

SCHEMBL9639072

C=C(C)C(=O)C(C)OC(C)C(=O)C(=C)C

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 2/20 0.36
HSD17B10 Q99714 1/20 0.33
CA1 P00915 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
SCHEMBL6695785 0.77 TSHR (0.45) TSHRALDH1A1TDP1
SCHEMBL4282536 0.77
SCHEMBL19402683 0.76 TSHR (0.63) TSHRALDH1A1
SCHEMBL3729839 0.75 TSHR (0.34) TSHRALDH1A1TDP1
SCHEMBL6343119 0.75 TSHR (0.39) TSHRALDH1A1TDP1HSD17B10
SCHEMBL5959710 0.75 TSHR (0.34) TSHRALDH1A1TDP1
SCHEMBL8155376 0.75 TDP1 (0.42) TSHRALDH1A1TDP1
SCHEMBL3673258 0.74 TSHR (0.33) TSHRALDH1A1
SCHEMBL8601903 0.74 HCAR2 (0.43) TSHRALDH1A1CA1
SCHEMBL4962596 0.74 TSHR (0.38) TSHRALDH1A1

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
US-5141436-A Etching, applying primer mixture of curable acrylate monomers and volatile solvent, then adhesive, curing by exposure to light SCIENTIFIC PHARMACEUTICALS, INC. (US) 1992-08-25 US disclosed