SCHEMBL29355151

SCHEMBL29355151

CC(=O)C(C)c1ncc(Cl)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
SMN1; SMN2 Q16637 5/20 0.43
LMNA P02545 4/20 0.43
GAA P10253 1/20 0.41
PLAU P00749 1/20 0.40
HTT P42858 3/20 0.38
MEN1 O00255 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MAPK1 P28482 3/20 0.37
S1PR1 P21453 2/20 0.37
S1PR3 Q99500 2/20 0.37
CYP2C9 P11712 1/20 0.37
TSHR P16473 1/20 0.37
APEX1 P27695 1/20 0.37
MAPT P10636 3/20 0.36
PTK2 Q05397 1/20 0.35
HSP90AA1 P07900 1/20 0.35
OPRK1 P41145 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 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
SCHEMBL22530887 1.00 KMT2A (0.46) KMT2ASMN1; SMN2LMNAGAAPLAU
SCHEMBL15999651 0.84 KMT2A (0.44) KMT2ASMN1; SMN2LMNAGAAHTT
SCHEMBL14921192 0.79 KMT2A (0.72) KMT2ASMN1; SMN2LMNAGAAHTT
SCHEMBL31518746 0.77 LMNA (0.41) KMT2ASMN1; SMN2LMNAPLAUMEN1
SCHEMBL2609312 0.77 LMNA (0.44) KMT2ASMN1; SMN2LMNAPLAUHTT
SCHEMBL14921448 0.76 KMT2A (0.47) KMT2ASMN1; SMN2LMNAGAAHTT
SCHEMBL18244479 0.75 LMNA (0.42) KMT2ASMN1; SMN2LMNAGAAPLAU
SCHEMBL14921447 0.75 KMT2A (0.55) KMT2ASMN1; SMN2LMNAGAAHTT
SCHEMBL22530398 0.74 LMNA (0.39) KMT2ASMN1; SMN2LMNAPLAUHTT
SCHEMBL29355779 0.74 LMNA (0.39) KMT2ASMN1; SMN2LMNAPLAUHTT

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-113966171-A Fungicidal compositions 先正达农作物保护股份公司 2022-01-21 CN disclosed