SCHEMBL31663316

SCHEMBL31663316

CC(=O)N1CCN(c2cncc(B(O)O)c2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 1/20 0.46
▸ CASP6 P55212 1/20 0.45
▸ GFER P55789 1/20 0.45
▸ TGFBR1 P36897 1/20 0.43
▸ ACVR1 Q04771 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ IDO1 P14902 2/20 0.41
▸ TDO2 P48775 1/20 0.41
▸ CYP2C9 P11712 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ HDAC8 Q9BY41 2/20 0.38
▸ GBA1 P04062 1/20 0.38
▸ HDAC3 O15379 1/20 0.38
▸ HDAC4 P56524 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC7 Q8WUI4 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ HDAC10 Q969S8 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
SCHEMBL2558075 0.81 CHEK1 (0.43) CYP11B2MEN1KMT2A
SCHEMBL19703391 0.80 GFER (0.49) CYP11B2CASP6GFERTGFBR1ACVR1
SCHEMBL15646504 0.79 CHRNB2 (0.45) —
SCHEMBL19279668 0.79 ADAMTS5 (0.53) CYP11B2CASP6GFERTGFBR1ACVR1
SCHEMBL2552859 0.78 GFER (0.50) CASP6GFERMEN1MAPTKMT2A
SCHEMBL19703394 0.77 CASP6 (0.49) CYP11B2CASP6GFERTGFBR1ACVR1
SCHEMBL21273927 0.76 GFER (0.65) CASP6GFERMEN1MAPTKMT2A
SCHEMBL29957858 0.75 LRRK2 (0.43) CYP11B2MAPTPIK3CD
SCHEMBL13671979 0.75 LRRK2 (0.43) CYP11B2MAPTPIK3CD
SCHEMBL15206038 0.74 CHRNB2 (0.55) CYP11B2CASP6GFERTGFBR1ACVR1

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-2025149628-A1 PIPERIDINE DERIVATIVES AS INHIBITORS OF NICOTINAMIDE N-METHYL TRANSFERASE ASTRAZENECA AB (SE) 2025-07-17 — — WO disclosed
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