SCHEMBL28417192

SCHEMBL28417192

Cc1ccc(C2(c3c[nH]c4ccccc34)Nc3ccccc3C2=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 4/20 0.47
GAA P10253 4/20 0.47
SI P14410 4/20 0.47
MGAM2 Q2M2H8 4/20 0.47
MAPT P10636 5/20 0.41
TP53 P04637 3/20 0.41
NTRK1 P04629 2/20 0.41
PRKD3 O94806 2/20 0.41
ABL1 P00519 2/20 0.41
DAPK3 O43293 1/20 0.41
MAP4K4 O95819 1/20 0.41
LCK P06239 1/20 0.41
FYN P06241 1/20 0.41
CSF1R P07333 1/20 0.41
RET P07949 1/20 0.41
PDGFRB P09619 1/20 0.41
PDGFRA P16234 1/20 0.41
LTK P29376 1/20 0.41
GRK5 P34947 1/20 0.41
KDR P35968 1/20 0.41

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
SCHEMBL29074194 0.90 MGAM (0.48) MGAMGAASIMGAM2TP53
SCHEMBL29396524 0.87 MGAM (0.52) MGAMGAASIMGAM2MAPT
SCHEMBL20550348 0.87 MGAM (0.52) MGAMGAASIMGAM2MAPT
SCHEMBL28417194 0.84 MGAM (0.48) MGAMGAASIMGAM2MAPT
SCHEMBL28415732 0.82 STING1 (0.42) MGAMGAASIMGAM2MAPT
SCHEMBL28415729 0.80 NTRK1 (0.44) MGAMGAASIMGAM2MAPT
SCHEMBL22890490 0.77 MGAM (0.43) MGAMGAASIMGAM2TP53
SCHEMBL29074193 0.77 GAA (0.50) MGAMGAASIMGAM2MAPT
SCHEMBL30923269 0.76 MGAM (0.43) MGAMGAASIMGAM2MAPT
SCHEMBL29222045 0.76 MGAM (0.43) MGAMGAASIMGAM2MAPT

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-111253300-B Bisindole compound and preparation method and application thereof 济南大学 2022-06-21 CN disclosed
CN-111253300-A Bisindole compound and preparation method and application thereof 济南大学 2020-06-09 CN disclosed