SCHEMBL8867192

SCHEMBL8867192

C=CC(=O)Nc1ccc(CC[O])cc1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRA P10827 2/20 0.65
THRB P10828 2/20 0.65
TGM2 P21980 15/20 0.58
F13A1 P00488 5/20 0.58
TGM1 P22735 5/20 0.58
LMNA P02545 1/20 0.58
TGM3 Q08188 1/20 0.58
FGFR1 P11362 1/20 0.44
FGFR4 P22455 1/20 0.44

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
SCHEMBL8867209 0.86 THRA (0.65) THRATHRBTGM2F13A1TGM1
SCHEMBL16242100 0.85 TGM2 (0.61) THRATHRBTGM2F13A1TGM1
SCHEMBL12265208 0.84 THRA (0.63) THRATHRBTGM2F13A1TGM1
SCHEMBL12832351 0.84 THRB (0.77) THRATHRBTGM2F13A1TGM1
SCHEMBL440756 0.83 TGM2 (0.63) THRATHRBTGM2F13A1TGM1
SCHEMBL11511625 0.83 THRA (0.61) THRATHRBTGM2F13A1TGM1
SCHEMBL439369 0.82 TGM2 (0.79) THRATHRBTGM2F13A1TGM1
SCHEMBL1191835 0.81 TGM2 (0.61) THRATHRBTGM2F13A1TGM1
SCHEMBL6677167 0.81 THRA (0.88) THRATHRBTGM2F13A1TGM1
SCHEMBL27632061 0.81 THRA (0.60) THRATHRBTGM2F13A1TGM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5686484-A ANTHELMINTICS, ACARICIDES, INSECTICIDES SANKYO CO., LTD. (JP) 1997-11-11 US disclosed