SCHEMBL28675693

SCHEMBL28675693

COc1ccc(-c2c(C)[nH]c3c(N)c(-c4ccccc4)nn3c2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 2/20 0.49
SLC11A2 P49281 2/20 0.45
MAPT P10636 5/20 0.43
TP53 P04637 1/20 0.43
HPGD P15428 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
POLB P06746 2/20 0.43
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
ADORA1 P30542 2/20 0.41
GABRP O00591 1/20 0.41
GABRD O14764 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB1 P18505 1/20 0.41
GABRG2 P18507 1/20 0.41

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
SCHEMBL19926788 0.90 MAT2A (0.58) MAT2ASLC11A2MAPTTP53HPGD
SCHEMBL31361390 0.85 MAT2A (0.48) MAT2ASLC11A2MAPTTP53HPGD
SCHEMBL31361358 0.84 MAT2A (0.47) MAT2ASLC11A2MAPTTP53HPGD
SCHEMBL31361461 0.84 MAT2A (0.51) MAT2ASLC11A2MAPTTP53HPGD
SCHEMBL31361363 0.83 MAT2A (0.49) MAT2ASLC11A2MAPTTP53HPGD
SCHEMBL31361434 0.83 MAT2A (0.51) MAT2ASLC11A2MAPTTP53HPGD
SCHEMBL28678700 0.83 SMN1; SMN2 (0.52) MAT2ASLC11A2MAPTTP53HPGD
SCHEMBL28676355 0.83 MAT2A (0.47) MAT2ASLC11A2MAPTTP53HPGD
SCHEMBL19972089 0.82 MAT2A (0.52) MAT2ASLC11A2MAPTTP53HPGD
SCHEMBL19926098 0.82 MAT2A (0.55) MAT2AMAPTTP53HPGDSMN1; 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 2 patents. 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
CN-113999232-A MAT2A inhibitors 南京正大天晴制药有限公司 2022-02-01 CN disclosed