SCHEMBL9615528

SCHEMBL9615528

[CH2]C(CCOCC)S(C)(=O)=O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
THRB P10828 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL21799402 0.74
SCHEMBL10733313 0.71 ALDH1A1 (0.41) ALDH1A1THRBTSHR
SCHEMBL10482402 0.69
SCHEMBL19062658 0.68 ALDH1A1 (0.31) ALDH1A1TSHR
SCHEMBL7481664 0.68 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL198309 0.68
SCHEMBL11882007 0.67
SCHEMBL10878395 0.67
SCHEMBL6130542 0.67
SCHEMBL8726374 0.67

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-5100751-A Liquid developing agent for electrostatic photography FUJI PHOTO FILM CO., LTD. (JP) 1992-03-31 US disclosed