SCHEMBL6033930

SCHEMBL6033930

O=C(CC(F)(F)C(F)(F)C(F)F)CC(F)(F)C(F)(F)C(F)F

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
KDM4E B2RXH2 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MAPT P10636 2/20 0.30
USP2 O75604 1/20 0.30
S1PR4 O95977 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
S1PR1 P21453 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL15402968 0.76
SCHEMBL5191388 0.75 TET2 (0.47) TSHRKDM4ETDP1
SCHEMBL25858196 0.75 TSHR (0.37) TSHRKDM4ETDP1USP2LMNA
SCHEMBL25982471 0.75 KDM4E (0.31) TSHRKDM4ETDP1
SCHEMBL25858208 0.72
SCHEMBL28752324 0.70 KDM4E (0.30) TSHRKDM4ETDP1
SCHEMBL186999 0.69 KDM4E (0.31) TSHRKDM4ETDP1
SCHEMBL157749 0.69 KDM4E (0.31) TSHRKDM4ETDP1
SCHEMBL31327517 0.69 LMNA (0.35) TSHRKDM4EMAPTS1PR4ALDH1A1
SCHEMBL8615910 0.69 TSHR (0.38) TSHRKDM4ETDP1MAPTUSP2

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-20060281644-A1 Method to synthesize fluorinated ZDDP PLATINUM RESEARCH ORGANIZATION (US) 2006-12-14 US disclosed