Sugi Predict

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SCHEMBL27780939

SCHEMBL27780939

Cc1ccc(S(=O)(=O)N2CCNC(C(=O)C3CN(S(=O)(=O)c4ccc(C)cc4)CCN3)C2)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ PKM P14618 3/20 0.50
▸ LMNA P02545 3/20 0.49
▸ POLB P06746 2/20 0.49
▸ HTT P42858 1/20 0.49
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47

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
SCHEMBL4041537 0.76 LMNA (0.53) ALDH1A1KMT2ALMNAPOLB
SCHEMBL26673580 0.75 ALDH1A1 (0.49) ALDH1A1KMT2APKMLMNA
SCHEMBL2446490 0.74 PKM (0.66) ALDH1A1KMT2APKMLMNAPOLB
SCHEMBL5955341 0.74 MAPT (0.69) ALDH1A1KMT2APKMLMNAPOLB
SCHEMBL651924 0.74 MAPT (0.69) ALDH1A1KMT2APKMLMNAPOLB
SCHEMBL9122576 0.74 MAPT (0.69) ALDH1A1KMT2APKMLMNAPOLB
SCHEMBL4750626 0.73 PKM (0.59) ALDH1A1KMT2APKMLMNAPOLB
SCHEMBL4750625 0.73 PKM (0.59) ALDH1A1KMT2APKMLMNAPOLB
SCHEMBL24072173 0.73 RAB9A (0.66) ALDH1A1KMT2APKMLMNAHTT
SCHEMBL24072200 0.73 RAB9A (0.66) ALDH1A1KMT2APKMLMNAHTT

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
CN-101712655-B Acetamide derivative and application thereof in pharmacy YINLIN QIN 2012-05-23 — — CN disclosed
CN-101712655-A Acetamide derivative and application thereof in pharmacy YINLIN QIN 2010-05-26 — — CN disclosed