SCHEMBL27615784

SCHEMBL27615784

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

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.41
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
APLNR P35414 1/20 0.31

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
SCHEMBL18630822 0.76 DGAT1 (0.44) DGAT1ALDH1A1TSHR
SCHEMBL27859821 0.76 DGAT1 (0.44) DGAT1ALDH1A1TSHR
SCHEMBL27482953 0.76 DGAT1 (0.44) DGAT1ALDH1A1TSHR
SCHEMBL1486198 0.76 DGAT1 (0.44) DGAT1ALDH1A1TSHR
SCHEMBL27721975 0.76 DGAT1 (0.44) DGAT1ALDH1A1TSHR
SCHEMBL18630824 0.76 DGAT1 (0.44) DGAT1ALDH1A1TSHR
SCHEMBL28535462 0.76 DGAT1 (0.44) DGAT1ALDH1A1TSHR
SCHEMBL5200727 0.75 DGAT1 (0.36) DGAT1
SCHEMBL28873923 0.75 DGAT1 (0.36) DGAT1
SCHEMBL27718962 0.75

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
CN-100365014-C Tumor targeting agents and uses thereof KARYON OY (FI) 2008-01-30 CN disclosed
CN-101027316-A Tumor targeting agent and application thereof KARYON OY (FI) 2007-08-29 CN disclosed
CN-1720259-A Tumor targeting agents and uses thereof KARYON OY (FI) 2006-01-11 CN disclosed
CN-1720258-A Tumor targeting agents and uses thereof KARYON OY (FI) 2006-01-11 CN disclosed