SCHEMBL23701150

SCHEMBL23701150

FC(F)(F)[Si](Cl)(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
ALDH1A1 P00352 1/20 0.38
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 0.36
CES1 P23141 1/20 0.36
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
KIF11 P52732 1/20 0.32
ACHE P22303 1/20 0.31
PKM P14618 1/20 0.31
NPSR1 Q6W5P4 1/20 0.30
PTPN1 P18031 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
SCHEMBL21438997 0.79 TSHR (0.38) TSHRALDH1A1NR1H2NR1H3CES1
SCHEMBL4241 0.74 ESR1 (0.34) TSHRALDH1A1NR1H2NR1H3ESR1
SCHEMBL1053231 0.72 ALDH1A1 (0.41) TSHRALDH1A1NR1H2NR1H3CES1
SCHEMBL1049841 0.72 ALDH1A1 (0.41) TSHRALDH1A1NR1H2NR1H3CES1
SCHEMBL1051334 0.72 ALDH1A1 (0.41) TSHRALDH1A1NR1H2NR1H3CES1
SCHEMBL6391397 0.72 ESR1 (0.33) TSHRALDH1A1NR1H2NR1H3ESR1
SCHEMBL4642449 0.72 NR1H2 (0.32) TSHRALDH1A1NR1H2NR1H3ESR1
SCHEMBL704206 0.71 ESR1 (0.40) TSHRALDH1A1NR1H2NR1H3ESR1
SCHEMBL705847 0.71 ESR1 (0.40) TSHRALDH1A1NR1H2NR1H3ESR1
SCHEMBL2492802 0.70 ESR1 (0.32) ALDH1A1NR1H2NR1H3ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11807758-B2 Siloxane polymer and method of producing siloxane polymer JNC CORPORATION (JP) 2023-11-07 US disclosed
US-20210238419-A1 SILOXANE POLYMER AND METHOD OF PRODUCING SILOXANE POLYMER JNC CORPORATION (JP) 2021-08-05 US disclosed