SCHEMBL28465404

SCHEMBL28465404

CC(C)CC(C)c1ccccc1NC(=O)c1snc(Cl)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 5/20 0.39
ALDH1A1 P00352 5/20 0.39
HTT P42858 2/20 0.39
KMT2A Q03164 3/20 0.37
PKM P14618 1/20 0.36
ANPEP P15144 1/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAPT P10636 2/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL3250285 0.81 SMN1; SMN2 (0.37) USP2SMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL13304854 0.78 KMT2A (0.65) SMN1; SMN2ALDH1A1HTTKMT2APKM
SCHEMBL17342166 0.77 HTT (0.54) USP2SMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL1449903 0.75 RAB9A (0.55) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL4831743 0.75 HPGD (0.59) ALDH1A1HTTKMT2AANPEPMEN1
SCHEMBL28539209 0.75 ALDH1A1 (0.45) USP2SMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL28540549 0.75 SMN1; SMN2 (0.54) USP2SMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL14302077 0.75 HDAC1 (0.52) USP2ALDH1A1HTTKMT2AMEN1
SCHEMBL13304549 0.74 ATM (0.46) SMN1; SMN2
SCHEMBL3258073 0.74 RAB9A (0.42) SMN1; SMN2ALDH1A1HTTKMT2APKM

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
CN-111788200-A Imide derivative and fungicide comprising the same as active ingredient 北兴化学工业株式会社 2020-10-16 CN disclosed