SCHEMBL29934945

SCHEMBL29934945

Cc1ccc2c(c1)c1ccccc1n2C=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.43
RORA P35398 1/20 0.43
RORC P51449 1/20 0.43
RORB Q92753 1/20 0.43
MAPT P10636 5/20 0.41
HTT P42858 3/20 0.41
LMNA P02545 1/20 0.41
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
HPGD P15428 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
ALDH1A1 P00352 2/20 0.40
IMPDH2 P12268 1/20 0.40
PTGER4 P35408 1/20 0.39
KDM4E B2RXH2 3/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
MARK4 Q96L34 2/20 0.38
UBE2N P61088 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL3082113 0.84 MAPT (0.45) PGRRORARORCRORBMAPT
SCHEMBL30046327 0.82 GPR3 (0.46) MAPTLMNAALDH1A1IMPDH2KDM4E
SCHEMBL30633063 0.82 GPR3 (0.46) MAPTLMNAALDH1A1IMPDH2KDM4E
SCHEMBL2258634 0.82 GPR3 (0.46) MAPTLMNAALDH1A1IMPDH2KDM4E
SCHEMBL4985558 0.82 MAPT (0.41) PGRRORARORCRORBMAPT
SCHEMBL27426783 0.79 BCHE (0.46) PGRRORARORCRORBMAPT
SCHEMBL22166470 0.79 PTGER4 (0.56) MAPTHTTLMNAHPGDALDH1A1
SCHEMBL881552 0.77 GPR3 (0.67) PGRRORARORCRORBMAPT
SCHEMBL23491106 0.76 BCHE (0.44) PGRRORARORCRORBMAPT
SCHEMBL23352488 0.76 BCHE (0.44) PGRRORARORCRORBMAPT

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
US-20220291237-A1 Gene Expression Inflammatory Age and Its Uses Edifice Health, Inc. (US) 2022-09-15 US disclosed