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Sugi Predict / Compounds / SCHEMBL4537246

SCHEMBL4537246

SCHEMBL4537246

Cc1c(Cl)cccc1S(=O)(=O)N1CCCC(CNC(=O)N[C]2CCCCCCC2)C1.[CH2].[CH2]

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 9/20 0.56
▸ TP53 P04637 3/20 0.49
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ EPHX2 P34913 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ DCTPP1 Q9H773 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
SCHEMBL4542938 0.92 HSD11B1 (0.51) HSD11B1TP53EPHX2DCTPP1
SCHEMBL4539885 0.91 FAAH (0.45) HSD11B1TP53EPHX2
SCHEMBL4531620 0.87 HSD11B1 (0.58) HSD11B1TP53MEN1KMT2ANPC1
SCHEMBL4537189 0.87 FAAH (0.49) HSD11B1TP53EPHX2
SCHEMBL4306300 0.84 HSD11B1 (0.69) HSD11B1TP53MEN1KMT2AEPHX2
SCHEMBL4535088 0.84 USP30 (0.47) TP53MEN1KMT2AEPHX2MAPT
SCHEMBL4541794 0.84 HSD11B1 (0.54) HSD11B1TP53
SCHEMBL4539565 0.83 EPHX2 (0.48) TP53MEN1KMT2AEPHX2MAPT
SCHEMBL4536853 0.82 EPHX1 (0.49) TP53MEN1KMT2AEPHX2MAPT
SCHEMBL4542594 0.82 MEN1 (0.47) TP53MEN1KMT2AEPHX2MAPT

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-2009070497-A1 SEH AND 11 β-HSD1 INHIBITORS AND THEIR USE SMITHKLINE BEECHAM CORPORATION (US) 2009-06-04 — — WO claimed
WO-2009070497-A1 SEH AND 11 β-HSD1 INHIBITORS AND THEIR USE SMITHKLINE BEECHAM CORPORATION (US) 2009-06-04 — — WO disclosed