SCHEMBL31361411

SCHEMBL31361411

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

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAT2A P31153 5/20 0.52
▸ KIF11 P52732 4/20 0.41
▸ OPRD1 P41143 1/20 0.38
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ ALKBH3 Q96Q83 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ NPSR1 Q6W5P4 4/20 0.35
▸ LMNA P02545 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ GLA P06280 1/20 0.35
▸ HTT P42858 2/20 0.35
▸ MET P08581 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
SCHEMBL31361350 0.90 MAT2A (0.42) MAT2AKIF11MEN1KMT2AALKBH3
SCHEMBL31361266 0.89 MEN1 (0.48) MAT2AMEN1KMT2AALKBH3ALDH1A1
SCHEMBL31361448 0.87 P2RX3 (0.39) MAT2AMEN1KMT2AALKBH3ALDH1A1
SCHEMBL31361426 0.86 MAT2A (0.41) MAT2AMEN1KMT2AALDH1A1NPSR1
SCHEMBL31361403 0.86 MAT2A (0.39) MAT2AKIF11MEN1KMT2AALKBH3
SCHEMBL31361328 0.85 MAT2A (0.42) MAT2AKIF11MEN1KMT2AALDH1A1
SCHEMBL31361346 0.85 MEN1 (0.39) MAT2AKIF11MEN1KMT2AALKBH3
SCHEMBL31361364 0.85 KMT2A (0.40) MAT2AMEN1KMT2AALDH1A1NPSR1
SCHEMBL31361339 0.84 MAT2A (0.39) MAT2AMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL19927037 0.84 MAT2A (0.66) MAT2AMEN1KMT2AALDH1A1NPSR1

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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