SCHEMBL30409231

SCHEMBL30409231

FC(F)(F)c1cnc(N2CCC3(CC2)OCCO3)c(Cl)c1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.61
SMN1; SMN2 Q16637 9/20 0.57
LMNA P02545 4/20 0.57
HTT P42858 3/20 0.57
NPSR1 Q6W5P4 3/20 0.57
MAPT P10636 5/20 0.53
HPGD P15428 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
ALDH1A1 P00352 3/20 0.51
TP53 P04637 1/20 0.51
KDM4E B2RXH2 1/20 0.48
GAA P10253 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
HSD11B1 P28845 1/20 0.47

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
SCHEMBL25224506 1.00 POLB (0.61) POLBSMN1; SMN2LMNAHTTNPSR1
SCHEMBL12491001 0.85 SMN1; SMN2 (0.43) POLBSMN1; SMN2LMNAHTTNPSR1
SCHEMBL3928781 0.82 POLB (0.69) POLBSMN1; SMN2LMNAHTTNPSR1
SCHEMBL9105524 0.80 POLB (0.75) POLBSMN1; SMN2LMNAHTTNPSR1
SCHEMBL16467131 0.80 SMN1; SMN2 (0.42) POLBSMN1; SMN2LMNAHTTNPSR1
SCHEMBL4907149 0.77 POLB (0.71) POLBSMN1; SMN2LMNAHTTNPSR1
SCHEMBL1999759 0.77 POLB (0.71) POLBSMN1; SMN2LMNAHTTNPSR1
SCHEMBL1350989 0.77 POLB (0.66) POLBSMN1; SMN2LMNAHTTNPSR1
SCHEMBL11946907 0.76 ALDH1A1 (0.40) POLBSMN1; SMN2LMNAHTTNPSR1
SCHEMBL232841 0.76 POLB (0.69) POLBSMN1; SMN2LMNAHTTNPSR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4436975-A1 SPIROCYCLIC CYCLIC MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYELINATION Genentech, Inc. (US) 2024-10-02 EP disclosed
CN-118696050-A Spirocyclic cyclic modulators of cholesterol biosynthesis and their use for promoting remyelination 基因泰克公司 2024-09-24 CN disclosed
WO-2023097233-A1 SPIROCYCLIC CYCLIC MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYELINATION GENENTECH, INC. (US) 2023-06-01 WO disclosed