SCHEMBL22760451

SCHEMBL22760451

CCN(CC)c1c(C(=O)Cl)n(-c2ccccc2)c2ccc(F)c(F)c12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.34
TSHR P16473 1/20 0.34
EGFR P00533 2/20 0.34
MAPT P10636 4/20 0.33
GAA P10253 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TP53 P04637 2/20 0.33
THRB P10828 1/20 0.33
EDNRA P25101 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
MAPK8 P45983 5/20 0.32
JAK2 O60674 1/20 0.31
JAK3 P52333 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
KDM4E B2RXH2 1/20 0.31
PRMT5 O14744 1/20 0.31
CYP1A2 P05177 1/20 0.31
MAT2A P31153 1/20 0.31
NPC1 O15118 1/20 0.30

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
SCHEMBL22760117 0.91 FOLH1 (0.36) LMNATSHREGFRMAPTGAA
SCHEMBL22748263 0.86 MAPK8 (0.40) MAPTGAAALDH1A1TP53THRB
SCHEMBL22747883 0.85 MAPT (0.50) LMNAMAPTGAAALDH1A1TP53
SCHEMBL22747829 0.81 FOLH1 (0.35) LMNATSHREGFRMAPTGAA
SCHEMBL22760085 0.81 EDNRA (0.37) LMNATSHREGFRMAPTGAA
SCHEMBL22760414 0.79 EGFR (0.33) EGFRMAPTGAAMEN1KMT2A
SCHEMBL22747868 0.79 FOLH1 (0.35) LMNATSHREGFRMAPTGAA
SCHEMBL22760376 0.77 MAPK8 (0.41) MAPK8PRMT5CYP1A2MAT2AFOLH1
SCHEMBL22760095 0.77 MAPT (0.48) MAPTGAAALDH1A1TP53THRB
SCHEMBL22760364 0.75 FOLH1 (0.37) LMNATSHREGFRMAPTGAA

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
WO-2020244462-A1 INDOLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF 中国药科大学 2020-12-10 WO disclosed