SCHEMBL31361465

SCHEMBL31361465

COc1ccc(Cc2c(C)[nH]c3c(N4CCCCC4)c(-c4ccccc4)nn3c2=O)cc1C1CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 1/20 0.38
▸ NR3C2 P08235 1/20 0.38
▸ MAT2A P31153 3/20 0.38
▸ KMT2A Q03164 4/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ NPSR1 Q6W5P4 3/20 0.37
▸ HTT P42858 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ HRH1 P35367 1/20 0.35
▸ TNKS O95271 1/20 0.33
▸ TNKS2 Q9H2K2 1/20 0.33
▸ LMNA P02545 3/20 0.33
▸ PDE2A O00408 2/20 0.33
▸ PLAT P00750 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ PDE4A P27815 1/20 0.33
▸ PDE4B Q07343 1/20 0.33
▸ PDE4C Q08493 1/20 0.33
▸ PDE4D Q08499 1/20 0.33
▸ MAPT P10636 2/20 0.32

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
SCHEMBL31361364 0.92 KMT2A (0.40) MAT2AKMT2AMEN1NPSR1HTT
SCHEMBL31361455 0.90 KMT2A (0.40) MAT2AKMT2AMEN1NPSR1HTT
SCHEMBL31361381 0.89 KMT2A (0.38) MAT2AKMT2AMEN1NPSR1HTT
SCHEMBL31361380 0.89 NPSR1 (0.43) MAT2AKMT2AMEN1NPSR1HTT
SCHEMBL31361366 0.88 KMT2A (0.38) MAT2AKMT2AMEN1NPSR1HTT
SCHEMBL31361399 0.88 RNASEH1 (0.40) MAT2AKMT2AMEN1NPSR1HTT
SCHEMBL31361311 0.88 HTT (0.39) MAT2AKMT2AMEN1NPSR1HTT
SCHEMBL31361426 0.88 MAT2A (0.41) MAT2AKMT2AMEN1NPSR1HTT
SCHEMBL31361356 0.88 KMT2A (0.41) MAT2AKMT2AMEN1NPSR1HTT
SCHEMBL31361416 0.87 TUBB4A (0.41) MAT2AKMT2AMEN1NPSR1HTT

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
CN-113999232-B MAT2A inhibitors 南京正大天晴制药有限公司 2025-01-07 — — CN disclosed
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