SCHEMBL25039175

SCHEMBL25039175

CCCCCCC(C)(CCCCC)c1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CNR2 P34972 5/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
KCNH2 Q12809 4/20 0.40
SCN5A Q14524 3/20 0.40
SCN9A Q15858 3/20 0.40
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
BCL2 P10415 1/20 0.39
CNR1 P21554 4/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL25039041 1.00 SMN1; SMN2 (0.44) SMN1; SMN2POLBL3MBTL1CNR2MEN1
SCHEMBL19592942 0.96 SMN1; SMN2 (0.41) SMN1; SMN2POLBL3MBTL1CNR2MEN1
SCHEMBL20927022 0.85 SMN1; SMN2 (0.44) SMN1; SMN2POLBL3MBTL1MEN1KMT2A
SCHEMBL22175881 0.82 CNR2 (0.56) SMN1; SMN2POLBL3MBTL1CNR2MEN1
SCHEMBL22920991 0.81 CNR2 (0.54) CNR2CNR1ALDH1A1
SCHEMBL16769060 0.81 ESR1 (0.58) CNR2KDM4ECNR1ALDH1A1
SCHEMBL20243874 0.81 CNR2 (0.54) CNR2CNR1ALDH1A1
SCHEMBL22921038 0.81 CNR2 (0.54) CNR2CNR1ALDH1A1
SCHEMBL20097921 0.81 CNR2 (0.42) CNR2GAACNR1
SCHEMBL26938838 0.81 CNR2 (0.42) CNR2CNR1

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-4134076-A1 THERAPY FOR INHIBITION OF SINGLE-STRANDED RNA VIRUS REPLICATION Redhill Biopharma Ltd. (IL) 2023-02-15 EP disclosed