SCHEMBL19332216

SCHEMBL19332216

Cn1c(C(=O)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)cc2c(Cl)cc(Cl)cc21

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.57
▸ TP53 P04637 2/20 0.57
▸ POLB P06746 2/20 0.56
▸ KMT2A Q03164 8/20 0.54
▸ MEN1 O00255 5/20 0.54
▸ KDM4E B2RXH2 4/20 0.54
▸ TDP1 Q9NUW8 3/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ ALDH1A1 P00352 4/20 0.51
▸ THRB P10828 1/20 0.51
▸ HPGD P15428 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ RXFP1 Q9HBX9 1/20 0.50
▸ USP2 O75604 1/20 0.49
▸ LMNA P02545 1/20 0.49

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
SCHEMBL19346220 0.91 MAPT (0.56) MAPTTP53POLBKMT2AMEN1
SCHEMBL19346219 0.91 TP53 (0.55) MAPTTP53POLBKMT2AMEN1
SCHEMBL19332443 0.86 TDP1 (0.56) MAPTTP53POLBKMT2AMEN1
SCHEMBL19346002 0.85 AVPR2 (0.64) MAPTPOLBKMT2AMEN1KDM4E
SCHEMBL19345884 0.85 GPR27 (0.43) MAPTTP53KMT2AMEN1HPGD
SCHEMBL19332597 0.84 MAPT (0.54) MAPTTP53POLBKMT2AMEN1
SCHEMBL17593276 0.83 RXFP1 (0.65) MAPTTP53POLBKMT2AMEN1
SCHEMBL19345886 0.83 ALPL (0.49) KMT2AMEN1L3MBTL1ALDH1A1RXFP1
SCHEMBL19345890 0.83 SCN3A (0.52) ALDH1A1NPSR1RXFP1LMNA
SCHEMBL19332346 0.83 L3MBTL1 (0.52) MAPTTP53POLBKMT2AMEN1

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
WO-2017156181-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. (US) 2017-09-14 — — WO disclosed
WO-2017156181-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. (US) 2017-09-14 — — WO disclosed
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