SCHEMBL7933782

SCHEMBL7933782

CN(C(=O)OC(C)(C)C)[C@@H]1CCN(Cc2ccccc2)C1=O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 1/20 0.44
▸ FNTB P49356 1/20 0.44
▸ PGGT1B P53609 1/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ BCHE P06276 3/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ JAK2 O60674 1/20 0.41
▸ JAK1 P23458 1/20 0.41
▸ STS P08842 1/20 0.40
▸ FKBP1A P62942 1/20 0.40
▸ ACHE P22303 3/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40

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
SCHEMBL28337159 0.82 ACE (0.43) STS
SCHEMBL26891446 0.79 HSD11B1 (0.35) FNTAFNTBPGGT1BKCNH2
SCHEMBL803672 0.77 SIGMAR1 (0.59) KCNH2BCHEACHEHTR2C
SCHEMBL19734754 0.76 BCHE (0.56) L3MBTL1BCHEKMT2AACHE
SCHEMBL6818563 0.75 KMT2A (0.56) L3MBTL1KMT2AHDAC1HDAC8HDAC6
SCHEMBL7507555 0.75 SIGMAR1 (0.51) KCNH2BCHEACHEHTR2C
SCHEMBL20487341 0.75 NFKB1 (0.39) KMT2AFKBP1A
SCHEMBL20481011 0.75 NFKB1 (0.39) KMT2AFKBP1A
SCHEMBL7936884 0.75 KMT2A (0.56) L3MBTL1KMT2AHDAC1HDAC8HDAC6
SCHEMBL3815654 0.75 SIGMAR1 (0.51) KCNH2BCHEACHEHTR2C

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-2001017992-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-03-15 — — WO disclosed
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