SCHEMBL24124894

SCHEMBL24124894

CCCCCNSc1ccc(NC(=O)c2ccc3c(c2)N(C)C(=O)CS3)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.52
▸ KMT2A Q03164 8/20 0.52
▸ MEN1 O00255 7/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ HTT P42858 3/20 0.51
▸ OPRM1 P35372 1/20 0.51
▸ OPRD1 P41143 1/20 0.51
▸ ALDH1A1 P00352 5/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ POLB P06746 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ MAPK1 P28482 6/20 0.48
▸ ALOX15 P16050 2/20 0.46
▸ USP2 O75604 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ HSD17B10 Q99714 1/20 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
SCHEMBL24124783 0.87 ALDH1A1 (0.47) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL24124884 0.78 MAPT (0.64) MAPTKMT2AMEN1SMN1; SMN2HTT
SCHEMBL24124676 0.77 MAPT (0.55) MAPTKMT2AMEN1SMN1; SMN2HTT
SCHEMBL24124188 0.77 MAPT (0.62) MAPTKMT2AMEN1SMN1; SMN2HTT
SCHEMBL25920636 0.76 MAPT (0.60) MAPTKMT2AMEN1SMN1; SMN2HTT
SCHEMBL24124885 0.74 ALDH1A1 (0.52) MAPTKMT2AMEN1SMN1; SMN2HTT
SCHEMBL24124186 0.74 MAPT (0.57) MAPTKMT2AMEN1SMN1; SMN2HTT
SCHEMBL24124264 0.74 MAPT (0.57) MAPTKMT2AMEN1SMN1; SMN2HTT
SCHEMBL24124898 0.74 MAPT (0.57) MAPTKMT2AMEN1SMN1; SMN2HTT
SCHEMBL24125225 0.73 ALDH1A1 (0.51) MAPTKMT2AMEN1SMN1; SMN2HTT

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-2021257544-A1 SOX11 INHIBITORS FOR TREATING MANTLE CELL LYMPHOMA ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2021-12-23 — — WO disclosed
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