SCHEMBL21393352

SCHEMBL21393352

N=Cc1ncccc1C=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.53
TRIM33 Q9UPN9 2/20 0.53
KMT2A Q03164 4/20 0.42
LMNA P02545 3/20 0.42
MEN1 O00255 2/20 0.42
THRB P10828 1/20 0.42
BLM P54132 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KDM4E B2RXH2 2/20 0.41
NPC1 O15118 1/20 0.41
HSP90AA1 P07900 1/20 0.41
IDO1 P14902 1/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ERN1 O75460 4/20 0.37
ALDH1A1 P00352 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CCR1 P32246 1/20 0.36
CCR5 P51681 1/20 0.36

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
SCHEMBL346904 0.85 TRIM24 (0.59) TRIM24TRIM33KMT2ALMNAMEN1
SCHEMBL13617493 0.85 TRIM24 (0.39) TRIM24TRIM33KMT2ALMNAMEN1
SCHEMBL24466129 0.79 ALDH1A1 (0.35) TRIM24TRIM33KMT2AMEN1KDM4E
SCHEMBL4322480 0.79 TRIM24 (0.53) TRIM24TRIM33KMT2ALMNAMEN1
SCHEMBL30556656 0.79 TRIM24 (0.53) TRIM24TRIM33KMT2ALMNAMEN1
SCHEMBL19444863 0.76 FGF23 (0.36) TRIM24TRIM33KMT2AMEN1KDM4E
SCHEMBL16592377 0.76 FGF23 (0.33) TRIM24TRIM33KMT2AMEN1KDM4E
Pyrrole SCHEMBL28239882 0.75 TRIM24 (0.48) TRIM24TRIM33KMT2ALMNAMEN1
SCHEMBL8450489 0.73 FGF23 (0.48) TRIM24TRIM33KMT2ALMNAMEN1
SCHEMBL29773795 0.73 TRIM24 (0.61) TRIM24TRIM33KMT2ALMNAMEN1

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-114213422-A Superphanes super-sweet compound and preparation method and application thereof 湖南大学 2022-03-22 CN disclosed
WO-2019182925-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2019-09-26 WO disclosed