SCHEMBL28291958

SCHEMBL28291958

CCCCOC(=O)[C@H](C)NC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
NPSR1 Q6W5P4 2/20 0.46
ATM Q13315 1/20 0.44
ALPG P10696 1/20 0.43
PPARG P37231 1/20 0.43
HTT P42858 1/20 0.43
NCOA2 Q15596 1/20 0.43
NCOA1 Q15788 1/20 0.43
HCAR2 Q8TDS4 1/20 0.43
HPGD P15428 2/20 0.41
TSHR P16473 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 2/20 0.40
EPHX1 P07099 1/20 0.40
MAPK1 P28482 1/20 0.40
ACHE P22303 6/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL11983353 1.00 ALDH1A1 (0.47) ALDH1A1NPSR1ATMALPGPPARG
SCHEMBL28507143 0.85 ALDH1A1 (0.44) ALDH1A1NPSR1ATMALPGPPARG
SCHEMBL2027273 0.85 ALDH1A1 (0.52) ALDH1A1NPSR1ATMALPGPPARG
SCHEMBL12357211 0.85 ALDH1A1 (0.52) ALDH1A1NPSR1ATMALPGPPARG
SCHEMBL17991466 0.83 ALDH1A1 (0.45) ALDH1A1NPSR1ATMALPGPPARG
SCHEMBL18510055 0.82 ALDH1A1 (0.52) ALDH1A1NPSR1ATMALPGPPARG
SCHEMBL18510017 0.82 ALDH1A1 (0.52) ALDH1A1NPSR1ATMALPGPPARG
SCHEMBL27495595 0.81 SMN1; SMN2 (0.48) ALDH1A1ATMHPGDTSHRNPC1
SCHEMBL28565871 0.81 ALDH1A1 (0.44) ALDH1A1NPSR1ATMALPGPPARG
SCHEMBL28030905 0.81 MAPT (0.50) ALDH1A1NPSR1ATMPPARGHCAR2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110526903-A Bisindole maleimide derivative and its preparation method and application OCEAN UNIV CHINA 2019-12-03 CN disclosed
CN-110218206-A Bisindole maleimide derivative and its preparation method and application 中国海洋大学 2019-09-10 CN disclosed
CN-106083830-B Bisindolylmaleimide derivative and preparation method and application thereof 中国海洋大学 2019-07-12 CN disclosed
CN-106146475-B Bisindolylmaleimide derivative and preparation method and application thereof 中国海洋大学 2019-05-17 CN disclosed