SCHEMBL9049167

SCHEMBL9049167

O=C1CCC(C2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.46
ESR2 Q92731 2/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HRH3 Q9Y5N1 2/20 0.39
EPHX2 P34913 4/20 0.38
GRM2 Q14416 1/20 0.38
FAAH O00519 1/20 0.37
KDM1A O60341 1/20 0.37
RCOR1 Q9UKL0 1/20 0.37
FFAR4 Q5NUL3 1/20 0.36
PIM1 P11309 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
EPHX1 P07099 1/20 0.35
GPR174 Q9BXC1 1/20 0.35

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
SCHEMBL8467431 0.91 ESR2 (0.53) L3MBTL1ESR2MEN1KMT2AHRH3
SCHEMBL8767731 0.84 MEN1 (0.44) L3MBTL1MEN1KMT2AHRH3EPHX2
SCHEMBL4564168 0.83 L3MBTL1 (0.47) L3MBTL1MEN1KMT2AHRH3EPHX2
SCHEMBL18392454 0.83 EPHX2 (0.43) L3MBTL1MEN1KMT2AHRH3EPHX2
SCHEMBL14175478 0.82 ESR2 (0.37) L3MBTL1ESR2HRH3EPHX2
SCHEMBL14175480 0.82 ESR2 (0.37) L3MBTL1ESR2HRH3EPHX2
SCHEMBL22816885 0.81 L3MBTL1 (0.51) L3MBTL1ESR2MEN1KMT2AHRH3
SCHEMBL24505739 0.81 KDM1A (0.41) L3MBTL1MEN1KMT2AHRH3EPHX2
SCHEMBL9182271 0.81 MEN1 (0.40) L3MBTL1MEN1KMT2AHRH3EPHX2
SCHEMBL9979949 0.81 ESR2 (0.47) L3MBTL1ESR2MEN1KMT2AHRH3

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
JP-8012616-A None JP disclosed
JP-H0812616-A BICYCLOHEXAN-4-ONE DERIVATIVE DAINIPPON INK & CHEM INC 1996-01-16 JP disclosed