SCHEMBL8748928

SCHEMBL8748928

COC(=O)CCOc1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1Cl

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.54
MEN1 O00255 1/20 0.47
TTR P02766 1/20 0.47
PPOX P50336 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HTR2A P28223 3/20 0.47
SLC6A4 P31645 3/20 0.47
KCNH2 Q12809 3/20 0.47
MAPT P10636 1/20 0.46
PPARD Q03181 3/20 0.46
PPARA Q07869 3/20 0.46
PPARG P37231 3/20 0.46
MRGPRX4 Q96LA9 4/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL11094682 0.90 FFAR1 (0.48) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9711441 0.89 FFAR1 (0.54) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11183175 0.84 FFAR1 (0.45) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11097276 0.84 FFAR1 (0.47) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11231942 0.81 FFAR1 (0.50) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11120557 0.81 FFAR1 (0.48) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11417408 0.80 FFAR1 (0.49) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11209583 0.80 FFAR1 (0.53) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11097872 0.80 FFAR1 (0.53) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10947256 0.79 FFAR1 (0.48) FFAR1MEN1TTRPPOXKMT2A

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
EP-0768085-A1 ANTIBACTERIAL AGENT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-04-16 EP disclosed
EP-0761215-A1 ANTIBACTERIAL AGENT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-03-12 EP disclosed