SCHEMBL10836737

SCHEMBL10836737

CC(C)(COCc1ccc(F)c(Oc2ccccc2)c1)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.39
TACR1 P25103 3/20 0.36
RIPK1 Q13546 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR5 Q9H1C0 1/20 0.33
FFAR4 Q5NUL3 1/20 0.32
LMNA P02545 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
RHEB Q15382 2/20 0.32
SLC6A4 P31645 2/20 0.32
HTR2A P28223 1/20 0.32
KCNH2 Q12809 1/20 0.32

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
SCHEMBL9029398 0.91 TTR (0.39) TTRTACR1RIPK1CYP1A2CYP3A4
SCHEMBL10837667 0.90 TACR1 (0.42) TTRTACR1RIPK1LPAR1LPAR5
SCHEMBL10837405 0.88 TTR (0.37) TTRTACR1RIPK1CYP1A2CYP3A4
SCHEMBL10837117 0.88 NPC1 (0.38) TTRTACR1RIPK1CYP2C9LPAR1
SCHEMBL9558577 0.87 TTR (0.36) TTRTACR1SLC6A4HTR2AKCNH2
SCHEMBL10837586 0.87 TACR1 (0.37) TTRTACR1RIPK1LPAR1LPAR5
SCHEMBL10837451 0.87 TACR1 (0.37) TTRTACR1RIPK1LPAR1LPAR5
SCHEMBL9557873 0.87 NR4A1 (0.38) TTRTACR1RIPK1LPAR1LPAR5
SCHEMBL10837314 0.87 HTR2A (0.38) TTRTACR1RIPK1LPAR1LPAR5
SCHEMBL10836254 0.86 TTR (0.36) TTRTACR1SLC6A4HTR2AKCNH2

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-4599362-A 2-aryl-ethyl ether derivatives and insecticidal and acaricidal agents containing said derivatives MITSUITOATSU CHEMICALS, INC. (JP) 1986-07-08 US disclosed