SCHEMBL24865236

SCHEMBL24865236

Cn1c(=O)n(C)c2cc(Nc3ccc(N4CCCC4)cc3)ccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.49
ALDH1A1 P00352 5/20 0.49
TP53 P04637 2/20 0.49
HSD17B10 Q99714 1/20 0.49
GAA P10253 5/20 0.47
MAPT P10636 4/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 2/20 0.47
ALOX15 P16050 1/20 0.47
NR4A1 P22736 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HTT P42858 3/20 0.45
LMNA P02545 2/20 0.45
TRIM24 O15164 2/20 0.44
CD274 Q9NZQ7 1/20 0.44
BRD1 O95696 2/20 0.43
BRPF1 P55201 2/20 0.43
BCL6 P41182 2/20 0.43

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
SCHEMBL30336935 1.00 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1TP53HSD17B10GAA
SCHEMBL24865209 0.87 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1TP53HSD17B10GAA
SCHEMBL30336497 0.87 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1TP53HSD17B10GAA
SCHEMBL24865656 0.87 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1TP53HSD17B10GAA
SCHEMBL24865642 0.85 BCL6 (0.47) SMN1; SMN2ALDH1A1TP53HSD17B10GAA
SCHEMBL24865764 0.84 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1TP53HSD17B10GAA
SCHEMBL24865788 0.82 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1TP53HSD17B10GAA
SCHEMBL31123270 0.82 BCL6 (0.50) SMN1; SMN2ALDH1A1TP53HSD17B10GAA
SCHEMBL24865299 0.82 BCL6 (0.50) SMN1; SMN2ALDH1A1TP53HSD17B10GAA
SCHEMBL24865482 0.81 TRIM24 (0.44) SMN1; SMN2ALDH1A1TP53HSD17B10GAA

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-117999259-A Iron death modulators, their preparation and use 维泰瑞隆有限公司 2024-05-07 CN disclosed
WO-2023280296-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-01-12 WO disclosed