SCHEMBL31023942

SCHEMBL31023942

CNc1ncccc1C=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.52
TRIM33 Q9UPN9 2/20 0.52
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.41
LMNA P02545 1/20 0.41
THRB P10828 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
KDM4E B2RXH2 2/20 0.40
HSP90AA1 P07900 1/20 0.40
IDO1 P14902 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.39
CYP2A6 P11509 1/20 0.37
ERN1 O75460 1/20 0.36
CCR1 P32246 1/20 0.35

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
SCHEMBL1376029 1.00 TRIM24 (0.52) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL12754878 0.82 CDK4 (0.42) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL21284326 0.82 KDM4E (0.36) TRIM24TRIM33LMNANPC1RAB9A
SCHEMBL12521568 0.80 KDM4E (0.39) TRIM24TRIM33LMNANPC1RAB9A
SCHEMBL23426225 0.79 TRIM24 (0.47) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL3645300 0.79 TRIM24 (0.47) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL2465213 0.78 TRIM24 (0.46) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL29954898 0.78 TRIM24 (0.46) TRIM24TRIM33KMT2AMEN1NPC1
SCHEMBL3713256 0.76 TRIM24 (0.47) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL1376342 0.76 DHODH (0.56) TRIM24TRIM33KMT2AMEN1LMNA

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
CN-118369325-A Therapeutic compounds for HIV virus infection 吉利德科学公司 2024-07-19 CN disclosed