SCHEMBL31361448

SCHEMBL31361448

Cc1[nH]c2c(N3CCCCC3)c(-c3ccccc3)nn2c(=O)c1Cc1ccc(OC(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 2/20 0.39
▸ MAT2A P31153 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.37
▸ MAPT P10636 3/20 0.36
▸ KDM4A O75164 1/20 0.36
▸ KDM4C Q9H3R0 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ HIF1A Q16665 1/20 0.35
▸ LTA4H P09960 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ CACNA2D1 P54289 1/20 0.34

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
SCHEMBL31361266 0.90 MEN1 (0.48) MAT2ALMNAMEN1KMT2AHTT
SCHEMBL31361366 0.88 KMT2A (0.38) MAT2ALMNAMEN1KMT2AHTT
SCHEMBL31361403 0.87 MAT2A (0.39) MAT2AMEN1KMT2AHTTSMN1; SMN2
SCHEMBL31361411 0.87 MAT2A (0.52) MAT2ALMNAMEN1KMT2AHTT
SCHEMBL31361346 0.86 MEN1 (0.39) MAT2AMEN1KMT2AHTTSMN1; SMN2
SCHEMBL31361339 0.86 MAT2A (0.39) MAT2AMEN1KMT2AHTTSMN1; SMN2
SCHEMBL31361350 0.86 MAT2A (0.42) MAT2ALMNAMEN1KMT2AHTT
SCHEMBL31361364 0.83 KMT2A (0.40) MAT2ALMNAMEN1KMT2AHTT
SCHEMBL31361455 0.82 KMT2A (0.40) MAT2ALMNAMEN1KMT2AHTT
SCHEMBL31361328 0.81 MAT2A (0.42) MAT2ALMNAMEN1KMT2ASMN1; SMN2

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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