SCHEMBL7959686

SCHEMBL7959686

CC(C)OC(=O)C(I)CCCI

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
LMNA P02545 2/20 0.34

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
SCHEMBL7976432 0.96 TSHR (0.33) TSHRLMNA
SCHEMBL7067300 0.89 TSHR (0.37) TSHRLMNA
SCHEMBL21811640 0.81 LMNA (0.39) TSHRLMNA
SCHEMBL7970973 0.78 CA1 (0.41) TSHR
SCHEMBL7971402 0.77 CPB2 (0.41) LMNA
SCHEMBL21811517 0.76 TSHR (0.40) TSHRLMNA
SCHEMBL8016407 0.76 TSHR (0.40) TSHRLMNA
SCHEMBL7960205 0.75 ZDHHC7 (0.40) TSHRLMNA
SCHEMBL14214991 0.73 ALOX15 (0.44)
SCHEMBL7973143 0.73 CPB2 (0.42) LMNA

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-6172234-B1 Optically active cyclic amino acid ester derivatives and processes for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-01-09 US disclosed
EP-0976729-A1 Optically active cyclic amino acid ester derivatives and processes for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-02 EP disclosed