SCHEMBL3132069

SCHEMBL3132069

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

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.32
ALDH1A1 P00352 3/20 0.30
TP53 P04637 2/20 0.30
HIF1A Q16665 2/20 0.30
CYP3A4 P08684 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL2786092 0.98 TSHR (0.33) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL42234 0.91 TSHR (0.34) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL42474 0.82 TSHR (0.37) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL7070766 0.78 ALDH1A1 (0.32) TSHRALDH1A1
SCHEMBL28477271 0.74
SCHEMBL8592863 0.74 TSHR (0.43) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL23781397 0.73
SCHEMBL20515907 0.73
SCHEMBL9243024 0.73 HCAR2 (0.38)
SCHEMBL27773280 0.72 TSHR (0.42) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116404159-A Adhesive, and preparation method and application thereof 上海华谊三爱富新材料有限公司 2023-07-07 CN claimed
CN-116404159-A Adhesive, and preparation method and application thereof 上海华谊三爱富新材料有限公司 2023-07-07 CN disclosed
US-7687991-B2 Organic electroluminescence device CANON KABUSHIKI KAISHA (JP) 2010-03-30 US disclosed
US-20080012473-A1 ORGANIC ELECTROLUMINESCENCE DEVICE CANON KABUSHIKI KAISHA (JP) 2008-01-17 US disclosed
US-5312710-A Electrophotographic toner and process for producing the same FUJI XEROX CO., LTD. (JP) 1994-05-17 US disclosed