SCHEMBL17593329

SCHEMBL17593329

O=C(Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1)c1cc(-c2ccccc2F)n[nH]1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ IDE P14735 1/20 0.68
▸ PHGDH O43175 1/20 0.61
▸ MEN1 O00255 4/20 0.57
▸ KMT2A Q03164 4/20 0.57
▸ KDM4E B2RXH2 2/20 0.57
▸ ALDH1A1 P00352 1/20 0.57
▸ MAPT P10636 2/20 0.55
▸ LMNA P02545 1/20 0.55
▸ HPGD P15428 1/20 0.55
▸ TP53 P04637 2/20 0.53
▸ POLB P06746 2/20 0.53
▸ GRM4 Q14833 2/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ RXFP1 Q9HBX9 1/20 0.50
▸ DPP4 P27487 1/20 0.50

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
SCHEMBL17593234 0.87 IDE (0.67) IDEPHGDHMEN1KMT2AKDM4E
SCHEMBL17593188 0.87 IDE (0.69) IDEPHGDHMEN1KMT2AKDM4E
SCHEMBL17593117 0.85 PHGDH (0.81) IDEPHGDHMEN1KMT2AKDM4E
SCHEMBL17593316 0.85 IDE (0.67) IDEPHGDHMEN1KMT2AKDM4E
SCHEMBL17593045 0.81 IDE (1.00) IDEPHGDHMEN1KMT2AKDM4E
SCHEMBL17593266 0.78 IDE (0.60) IDEPHGDHMEN1KMT2AKDM4E
SCHEMBL17593104 0.77 MEN1 (0.76) IDEPHGDHMEN1KMT2AALDH1A1
SCHEMBL17593240 0.74 NPC1 (0.60) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL17592960 0.73 LMNA (0.69) IDEPHGDHMEN1KMT2AKDM4E
SCHEMBL19345935 0.73 MAPT (0.57) MEN1KMT2AKDM4EALDH1A1MAPT

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