SCHEMBL6987811

SCHEMBL6987811

O=C(O)C(c1c[nH]c2ccccc12)n1ccc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
PKM P14618 1/20 0.45
MGAM O43451 7/20 0.42
GAA P10253 7/20 0.42
SI P14410 7/20 0.42
MGAM2 Q2M2H8 7/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.42
MPO P05164 1/20 0.42
TSHR P16473 1/20 0.42
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42
HIF1A Q16665 1/20 0.42
GPR84 Q9NQS5 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
NOD2 Q9HC29 1/20 0.40
FFAR1 O14842 2/20 0.40
HDAC3 O15379 1/20 0.39

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
SCHEMBL27825647 0.79 GPR84 (0.50) MAPTMEN1KMT2ALMNAGPR84
SCHEMBL6689686 0.74 SLC6A4 (0.51) KMT2AGAALMNATSHRL3MBTL1
SCHEMBL28853261 0.71 MEN1 (0.56) MAPTMEN1KMT2APKMMGAM
SCHEMBL3370820 0.71 MEN1 (0.59) MAPTMEN1KMT2APKMMGAM
SCHEMBL7047429 0.71 MEN1 (0.59) MAPTMEN1KMT2APKMMGAM
SCHEMBL1893849 0.71 MEN1 (0.59) MAPTMEN1KMT2APKMMGAM
SCHEMBL28010909 0.70 KMT2A (0.45) MAPTMEN1KMT2APKMMGAM
SCHEMBL719008 0.70 MAPT (0.57) MAPTMEN1KMT2APKMMGAM
SCHEMBL6283244 0.70 GPR84 (0.59) MAPTMEN1KMT2APKMMGAM
SCHEMBL11412911 0.69 KMT2A (0.49) MEN1KMT2ALMNATSHRL3MBTL1

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
EP-1283836-A2 NEUROPROTECTIVE AND ANTI-PROLIFERATIVE COMPOUNDS Aegera Therapeutics Inc. (CA) 2003-02-19 EP disclosed
WO-2001087887-A2 NEUROPROTECTIVE AND ANTI-PROLIFERATIVE COMPOUNDS AEGERA THERAPEUTICS INC. (CA) 2001-11-22 WO disclosed