SCHEMBL7064526

SCHEMBL7064526

C=C(C#N)C(=O)OC(F)(F)C(F)(F)C(F)(F)C(F)F

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
ALDH1A1 P00352 1/20 0.37
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL7063322 0.94 TSHR (0.35) TSHRALDH1A1KDM4ETDP1
SCHEMBL7199625 0.90 ALDH1A1 (0.39) TSHRALDH1A1
SCHEMBL7063329 0.81 ALDH1A1 (0.33) TSHRALDH1A1
SCHEMBL7064537 0.80 ALDH1A1 (0.37) TSHRALDH1A1
SCHEMBL3132337 0.78 ALDH1A1 (0.42) TSHRALDH1A1
SCHEMBL3132355 0.78 ALDH1A1 (0.42) TSHRALDH1A1
SCHEMBL9617553 0.77 GAA (0.36) TSHRALDH1A1KDM4ETDP1
SCHEMBL13415386 0.76 TSHR (0.45) TSHRALDH1A1KDM4ETDP1
SCHEMBL8429717 0.76 ALDH1A1 (0.43) TSHRALDH1A1
SCHEMBL6915019 0.76 ALDH1A1 (0.39) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6607631-B1 Polymerizable monomer adhesive composition includes a 1,1-disubstituted ethylene monomer and at least one slip additive, where the slip additive causes a polymer film formed from the monomer to have a lower coefficient of friction than in an CLOSURE MEDICAL CORPORATION 2003-08-19 US claimed
WO-2002020684-A2 ADHESIVE COMPOSITIONS WITH REDUCED COEFFICIENT OF FRICTION CLOSURE MEDICAL CORPORATION (US) 2002-03-14 WO claimed
US-6607631-B1 Polymerizable monomer adhesive composition includes a 1,1-disubstituted ethylene monomer and at least one slip additive, where the slip additive causes a polymer film formed from the monomer to have a lower coefficient of friction than in an CLOSURE MEDICAL CORPORATION 2003-08-19 US disclosed
WO-2002020684-A2 ADHESIVE COMPOSITIONS WITH REDUCED COEFFICIENT OF FRICTION CLOSURE MEDICAL CORPORATION (US) 2002-03-14 WO disclosed