SCHEMBL9408471

SCHEMBL9408471

C=CC(C(=O)O)C1CCC([C@H]2CC[C@H](c3ccc(F)c(F)c3)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ USP5 P45974 2/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ USP30 Q70CQ3 1/20 0.33
▸ APP P05067 1/20 0.33
▸ DGAT1 O75907 1/20 0.32
▸ SOAT1 P35610 1/20 0.32
▸ HCRTR2 O43614 3/20 0.32
▸ CCR2 P41597 1/20 0.32
▸ DHODH Q02127 1/20 0.32
▸ SCD5 Q86SK9 1/20 0.31
▸ CCR1 P32246 1/20 0.31
▸ ACMSD Q8TDX5 2/20 0.31
▸ KDM1A O60341 1/20 0.31
▸ ADRA1A P35348 1/20 0.31

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
SCHEMBL9408419 0.96 USP5 (0.38) USP5HDAC6USP30APPDGAT1
SCHEMBL9408184 0.89 KDM1A (0.35) USP5HDAC6APPKDM1A
SCHEMBL9408358 0.89 USP5 (0.32) USP5HDAC6APP
SCHEMBL9408224 0.86 KDM1A (0.39) KDM1A
SCHEMBL9408288 0.86 DPP4 (0.37) USP5APPCCR2CCR1
SCHEMBL9408441 0.85 GPR139 (0.33) USP5HDAC6APP
SCHEMBL9408194 0.85 KDM1A (0.38) APPACMSDKDM1A
SCHEMBL9408244 0.83 BCL2L1 (0.39) CCR1
SCHEMBL9408209 0.82 KDM1A (0.40) USP30KDM1A
SCHEMBL9408328 0.82 USP5 (0.39) USP5HDAC6USP30APPDGAT1

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
EP-0595144-A1 Cyclohexyl alkenoates as components of liquid crystalline mixtures F. HOFFMANN-LA ROCHE AG (CH) 1994-05-04 — — EP disclosed
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