SCHEMBL31037653

SCHEMBL31037653

CC(C)(C)OC(=O)N1CCCCC1CNc1c(N)c(Cl)nc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.47
KDM1A O60341 1/20 0.45
PDE8B O95263 1/20 0.41
AHCY P23526 3/20 0.41
METTL3 Q86U44 1/20 0.41
OPRD1 P41143 1/20 0.41
PDE7B Q9NP56 1/20 0.40
ACACB O00763 1/20 0.40
ACACA Q13085 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
CHEK2 O96017 1/20 0.39
TSHR P16473 1/20 0.38
FPR3 P25089 1/20 0.38
FPR2 P25090 1/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
GAA P10253 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 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
SCHEMBL6923708 0.79 KDM4E (0.48) ACACBACACAMEN1KMT2A
SCHEMBL5337684 0.77 PRMT5 (0.53) PRMT5KDM1APDE8BMETTL3OPRD1
SCHEMBL31437092 0.76 KDM1A (0.52) PRMT5KDM1APDE8BAHCYMETTL3
SCHEMBL29131871 0.76 OPRD1 (0.46) PRMT5KDM1AAHCYOPRD1TSHR
SCHEMBL29131873 0.76 OPRD1 (0.46) PRMT5KDM1AAHCYOPRD1TSHR
SCHEMBL28332575 0.76 KDM1A (0.52) PRMT5KDM1APDE8BAHCYMETTL3
SCHEMBL1141261 0.75 OPRD1 (0.42) OPRD1TSHRMEN1NPC1GAA
SCHEMBL19141219 0.75 PRMT5 (0.53) PRMT5KDM1APDE8BMETTL3OPRD1
SCHEMBL12311356 0.74 OPRD1 (0.53) PRMT5KDM1AOPRD1TSHRFPR3
SCHEMBL1141198 0.74 HCRTR1 (0.37) MEN1GAAKMT2AALDH1A1ACHE

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
WO-2024138157-A1 NOVEL IMIDAZOQUINOLINES WITH IMMUNOSTIMULATORY EFFECTS SYNOVO GMBH (DE) 2024-06-27 WO disclosed