SCHEMBL7199630

SCHEMBL7199630

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

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TSHR P16473 2/20 0.39
HSD17B10 Q99714 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
SCHEMBL7064537 0.83 ALDH1A1 (0.37) ALDH1A1TSHR
SCHEMBL22462714 0.82 ALDH1A1 (0.43) ALDH1A1TSHR
SCHEMBL7063329 0.78 ALDH1A1 (0.33) ALDH1A1TSHR
SCHEMBL2831106 0.76 ALDH1A1 (0.38) ALDH1A1TSHRHSD17B10
SCHEMBL7199625 0.75 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL8429717 0.75 ALDH1A1 (0.43) ALDH1A1TSHR
SCHEMBL6915019 0.75 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL22426094 0.73 ALDH1A1 (0.48) ALDH1A1TSHR
SCHEMBL22426093 0.73 ALDH1A1 (0.44) ALDH1A1TSHR
SCHEMBL7064526 0.72 TSHR (0.37) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6602970-B2 A 2-cyanoacrylate composition has high curing rate and excellent moisture resistance, surface curability containing a cyclic phenol sulfide derivative TOAGOSEI CO., LTD. (JP) 2003-08-05 US claimed
US-6602970-B2 A 2-cyanoacrylate composition has high curing rate and excellent moisture resistance, surface curability containing a cyclic phenol sulfide derivative TOAGOSEI CO., LTD. (JP) 2003-08-05 US disclosed
US-20020029848-A1 2-cyanoacrylate composition TOAGOSEI CO., LTD. 2002-03-14 US disclosed