SCHEMBL23701389

SCHEMBL23701389

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

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 0.36
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34
KIF11 P52732 1/20 0.32
CES1 P23141 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
SCHEMBL7667669 0.74 ESR1 (0.34) ALDH1A1TSHRNR1H2NR1H3ESR1
SCHEMBL1049841 0.72 ALDH1A1 (0.41) ALDH1A1TSHRNR1H2NR1H3ESR1
SCHEMBL1053231 0.72 ALDH1A1 (0.41) ALDH1A1TSHRNR1H2NR1H3ESR1
SCHEMBL1051334 0.72 ALDH1A1 (0.41) ALDH1A1TSHRNR1H2NR1H3ESR1
SCHEMBL29054459 0.68 NR1H2 (0.45) ALDH1A1TSHRNR1H2NR1H3ESR1
SCHEMBL21438997 0.68 TSHR (0.38) ALDH1A1TSHRNR1H2NR1H3ESR1
SCHEMBL23701150 0.68 TSHR (0.38) ALDH1A1TSHRNR1H2NR1H3ESR1
SCHEMBL104796 0.68 NR1H2 (0.45) ALDH1A1TSHRNR1H2NR1H3ESR1
SCHEMBL874349 0.67 ESR1 (0.36) ALDH1A1TSHRESR1ESR2
SCHEMBL874968 0.67 ESR1 (0.36) ALDH1A1TSHRESR1ESR2

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