SCHEMBL10753752

SCHEMBL10753752

CC(C)Oc1ccc(C(C)(COCc2ccc(F)c(Oc3ccccc3)c2)C(F)F)cc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.36
CETP P11597 9/20 0.34
KCNH2 Q12809 7/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
PARP1 P09874 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
TACR1 P25103 1/20 0.32
PTGES O14684 1/20 0.32
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
LPAR1 Q92633 1/20 0.32
LPAR5 Q9H1C0 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
SCHEMBL10754114 0.93 MRGPRX4 (0.33) FFAR4KCNH2PARP1TACR1NPSR1
SCHEMBL10758162 0.90 LPAR1 (0.37) RAB9ALPAR1LPAR5
SCHEMBL10865914 0.90 NR4A1 (0.34) FFAR4RAB9AKMT2ATACR1NPSR1
SCHEMBL9798911 0.90 FFAR4 (0.38) FFAR4CETPKCNH2NPC1RAB9A
SCHEMBL10865141 0.90 HTR2A (0.34) MEN1KMT2ATACR1NPSR1LPAR1
SCHEMBL10836413 0.89 MRGPRX4 (0.33) FFAR4PARP1TACR1LPAR1LPAR5
SCHEMBL10750968 0.89 TTR (0.35) KCNH2TACR1NPSR1
SCHEMBL10752391 0.88 LTA4H (0.39) MEN1KMT2ATACR1MAPT
SCHEMBL9785737 0.88 SLC6A2 (0.36) CETPTACR1NPSR1LPAR1LPAR5
SCHEMBL10751071 0.88 SMN1; SMN2 (0.33) TACR1NPSR1LPAR1LPAR5

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-4678811-A INSECTICIDES, MITICIDES SCHERING AKTIENGESELLSCHAFT (DE) 1987-07-07 US claimed
EP-0179018-A1 Substituted benzyl ethers, pesticides containing these compounds and processes for their production SCHERING AKTIENGESELLSCHAFT (DE) 1986-04-23 EP claimed