SCHEMBL15840353

SCHEMBL15840353

C=C(C)C(=O)OC(C)(CCC)CC(F)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
THRB P10828 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL1108011 0.83 TSHR (0.41) TSHRTHRBALDH1A1
SCHEMBL23494134 0.80 TSHR (0.39) TSHRTHRBALDH1A1
SCHEMBL28006010 0.78 TSHR (0.38) TSHRTHRBALDH1A1
SCHEMBL27662665 0.76 TSHR (0.41) TSHRTHRBALDH1A1
SCHEMBL10701653 0.75 TSHR (0.38) TSHRTHRBALDH1A1
SCHEMBL27458125 0.75 TSHR (0.38) TSHRTHRBALDH1A1
SCHEMBL15132674 0.73 TSHR (0.33) TSHRTHRBALDH1A1
SCHEMBL15134124 0.73 TSHR (0.33) TSHRTHRBALDH1A1
SCHEMBL28126902 0.73 TSHR (0.47) TSHRTHRBALDH1A1
SCHEMBL27777481 0.72 TSHR (0.36) TSHRTHRBALDH1A1

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-20140178818-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-06-26 US disclosed