SCHEMBL23889659

SCHEMBL23889659

CC1(C(=O)NCCCCCN2C(=O)C=CC2=O)CCC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 2/20 0.49
▸ DRD4 P21917 2/20 0.49
▸ MGLL Q99685 5/20 0.46
▸ FAAH O00519 3/20 0.46
▸ HPGD P15428 3/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ LMNA P02545 2/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ HSP90AA1 P07900 1/20 0.46
▸ TLR9 Q9NR96 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ XBP1 P17861 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ GPR35 Q9HC97 1/20 0.46

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
SCHEMBL18100026 0.84 MGLL (0.44) MGLLFAAHHPGDSMN1; SMN2LMNA
SCHEMBL16834889 0.83 PTGS1 (0.47) MGLLFAAHHPGDSMN1; SMN2LMNA
SCHEMBL22220046 0.82 MGLL (0.41) MGLLFAAHHPGDSMN1; SMN2LMNA
SCHEMBL19061723 0.82 MGLL (0.44) DRD2DRD4MGLLFAAHHPGD
SCHEMBL22698762 0.79 MGLL (0.41) MGLLFAAHHPGDSMN1; SMN2LMNA
SCHEMBL16834912 0.78 DRD2 (0.39) DRD2MGLLFAAHHPGDSMN1; SMN2
SCHEMBL16847675 0.77 PTGS1 (0.44) MGLLFAAHHPGDSMN1; SMN2LMNA
SCHEMBL17813682 0.77 MGLL (0.36) DRD2DRD4MGLLFAAHHPGD
SCHEMBL11911312 0.76 MGLL (0.59) MGLLFAAHHPGDSMN1; SMN2LMNA
SCHEMBL19666091 0.75 MGLL (0.37) MGLLFAAHHPGDSMN1; SMN2LMNA

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-3464280-B1 SILVESTROL ANTIBODY-DRUG CONJUGATES AND METHODS OF USE HOFFMANN LA ROCHE (CH) 2021-10-06 — — EP disclosed
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