SCHEMBL17593045

SCHEMBL17593045

Cc1ccc(-c2cc(C(=O)Nc3ccc(S(=O)(=O)Nc4ncccn4)cc3)[nH]n2)c(O)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDE P14735 1/20 1.00
▸ KMT2A Q03164 7/20 0.66
▸ MEN1 O00255 6/20 0.66
▸ CACNA1B Q00975 1/20 0.66
▸ APBA1 Q02410 1/20 0.66
▸ POLB P06746 2/20 0.64
▸ CTDSP1 Q9GZU7 1/20 0.64
▸ RAC1 P63000 2/20 0.64
▸ MAPT P10636 4/20 0.61
▸ NPC1 O15118 2/20 0.61
▸ RAB9A P51151 2/20 0.61
▸ HPGD P15428 2/20 0.58
▸ LMNA P02545 1/20 0.58
▸ PHGDH O43175 1/20 0.55
▸ ALDH1A1 P00352 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ APEX1 P27695 1/20 0.49
▸ RECQL P46063 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
SCHEMBL17593188 0.82 IDE (0.69) IDEKMT2AMEN1POLBMAPT
SCHEMBL17593329 0.81 IDE (0.68) IDEKMT2AMEN1POLBMAPT
SCHEMBL17593316 0.80 IDE (0.67) IDEKMT2AMEN1POLBMAPT
SCHEMBL17593117 0.80 PHGDH (0.81) IDEKMT2AMEN1POLBMAPT
SCHEMBL17593234 0.80 IDE (0.67) IDEKMT2AMEN1POLBRAC1
SCHEMBL17593266 0.75 IDE (0.60) IDEKMT2AMEN1POLBMAPT
SCHEMBL17592960 0.73 LMNA (0.69) IDEKMT2AMEN1POLBMAPT
SCHEMBL17593104 0.72 MEN1 (0.76) IDEKMT2AMEN1RAC1MAPT
SCHEMBL17593267 0.71 L3MBTL1 (0.57) IDEKMT2AMEN1POLBMAPT
SCHEMBL19345895 0.70 IDE (0.54) IDEKMT2AMEN1POLBMAPT

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-2016040449-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. (US) 2016-03-17 — — WO claimed
WO-2016040449-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. (US) 2016-03-17 — — WO disclosed
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