SCHEMBL28600464

SCHEMBL28600464

COC(=O)c1ccccc1NC(=O)Cc1ccccc1Cl

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 2/20 0.68
MAPK8 P45983 1/20 0.68
MAPK9 P45984 1/20 0.68
KMT2A Q03164 1/20 0.66
ALDH1A1 P00352 5/20 0.60
HTT P42858 2/20 0.60
KDM4E B2RXH2 4/20 0.57
HSD17B10 Q99714 3/20 0.57
TSHR P16473 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.54
KCNQ2 O43526 1/20 0.54
GAA P10253 3/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
TP53 P04637 1/20 0.52

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
SCHEMBL9211450 0.85 MAPK10 (0.59) MAPK10MAPK8MAPK9KMT2AALDH1A1
SCHEMBL15647914 0.85 GAA (0.56) MAPK10MAPK8MAPK9KMT2AALDH1A1
SCHEMBL10650158 0.84 MAPK10 (0.70) MAPK10MAPK8MAPK9KMT2AALDH1A1
SCHEMBL9207874 0.84 KMT2A (0.59) MAPK10MAPK8MAPK9KMT2AALDH1A1
SCHEMBL8632192 0.84 KCNQ2 (0.58) MAPK10MAPK8MAPK9KMT2AALDH1A1
SCHEMBL28600470 0.84 KMT2A (0.66) MAPK8KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL8636686 0.84 MAPK8 (0.67) MAPK8KMT2AALDH1A1KDM4EKCNQ2
SCHEMBL10340210 0.83 MAPT (0.71) MAPK10MAPK8MAPK9KMT2AALDH1A1
SCHEMBL28618234 0.83 ALDH1A1 (0.54) MAPK10MAPK8MAPK9KMT2AALDH1A1
SCHEMBL28605594 0.81 MAPK8 (1.00) MAPK10MAPK8MAPK9KMT2AALDH1A1

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-113248399-A O-amino aromatic amide derivative and preparation method and application thereof 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) 2021-08-13 CN disclosed