SCHEMBL21216253

SCHEMBL21216253

CC(C)(C)OC(=O)N1CCCCC1CN(Cc1ccccc1)C[C@@H](O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.42
▸ ATM Q13315 2/20 0.41
▸ JAK2 O60674 1/20 0.41
▸ JAK1 P23458 1/20 0.41
▸ PRMT5 O14744 1/20 0.41
▸ FKBP1A P62942 6/20 0.39
▸ KLK7 P49862 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ NR1H2 P55055 2/20 0.38
▸ NR1H3 Q13133 2/20 0.38
▸ OPRD1 P41143 1/20 0.38
▸ CPT2 P23786 1/20 0.38
▸ CPT1A P50416 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
SCHEMBL21202236 1.00 KDM1A (0.42) KDM1AATMJAK2JAK1PRMT5
SCHEMBL20535908 0.86 LMNA (0.41) LMNAKDM4E
SCHEMBL21216118 0.84 KDM1A (0.46) KDM1AATMJAK2JAK1PRMT5
SCHEMBL21216231 0.81 JAK2 (0.44) KDM1AATMJAK2JAK1PRMT5
SCHEMBL21216112 0.81 JAK2 (0.44) KDM1AATMJAK2JAK1PRMT5
SCHEMBL20535227 0.81 FKBP1A (0.36) ATMFKBP1ALMNAKDM4E
SCHEMBL5177116 0.80 KDM1A (0.46) KDM1AATMPRMT5FKBP1ALMNA
SCHEMBL5156033 0.79 KDM1A (0.42) KDM1AATMJAK2JAK1PRMT5
SCHEMBL5159359 0.79 KDM1A (0.42) KDM1AATMJAK2JAK1PRMT5
SCHEMBL20535226 0.79 KDM4E (0.40) LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019145713-A9 OLIGONUCLEOTIDE AND NUCLEIC ACID SYNTHESIS EVONETIX LTD (GB) 2020-08-06 — — WO disclosed
WO-2019145713-A1 OLIGONUCLEOTIDE AND NUCLEIC ACID SYNTHESIS EVONETIX LTD (GB) 2019-08-01 — — WO disclosed
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