SCHEMBL14064205

SCHEMBL14064205

OC1CCC(C2CCC(CCc3ccc(-c4ccc(F)c(F)c4)cc3)CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.40
CYP17A1 P05093 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
KIF11 P52732 1/20 0.35
GRIN2B Q13224 1/20 0.34
MAOB P27338 1/20 0.34
RARB P10826 2/20 0.33
RARA P10276 1/20 0.33
RARG P13631 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
NPC1 O15118 1/20 0.33
CHRM4 P08173 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
AXL P30530 1/20 0.32
TYRO3 Q06418 1/20 0.32
MERTK Q12866 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
CTSD P07339 1/20 0.32
FFAR4 Q5NUL3 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
SCHEMBL14064240 0.96 GPR84 (0.43) GPR84CYP17A1CYP11B1CYP11B2KIF11
SCHEMBL14064203 0.89 GPR84 (0.40) GPR84KIF11MAOBRARBRARA
SCHEMBL8768373 0.89 CYP17A1 (0.41) GPR84CYP17A1CYP11B1CYP11B2KIF11
SCHEMBL8768381 0.89 CYP17A1 (0.41) GPR84CYP17A1CYP11B1CYP11B2KIF11
SCHEMBL14064204 0.86 MAOB (0.46) GPR84MAOBTAAR1MERTK
SCHEMBL14064241 0.85 GPR84 (0.43) GPR84CYP17A1CYP11B1KIF11MAOB
SCHEMBL8019283 0.83 CYP17A1 (0.37) GPR84CYP17A1CYP11B1CYP11B2KIF11
SCHEMBL8019285 0.83 CYP17A1 (0.37) GPR84CYP17A1CYP11B1CYP11B2KIF11
SCHEMBL8019284 0.83 CYP17A1 (0.37) GPR84CYP17A1CYP11B1CYP11B2KIF11
SCHEMBL9139450 0.83 CYP17A1 (0.37) GPR84CYP17A1CYP11B1CYP11B2KIF11

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-7425354-B2 Photopolymerizable liquid crystal composition, its polymer or polymer composition, and optical compensation element CHISSO CORPORATION (JP) 2008-09-16 US disclosed