SCHEMBL15530810

SCHEMBL15530810

O=Cc1cccnc1NCCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.58
RAB9A P51151 3/20 0.58
NPC1 O15118 2/20 0.58
KMT2A Q03164 7/20 0.54
MEN1 O00255 6/20 0.54
KDM4E B2RXH2 4/20 0.54
LMNA P02545 3/20 0.54
HTT P42858 3/20 0.54
TDP1 Q9NUW8 2/20 0.54
GLA P06280 1/20 0.54
L3MBTL1 Q9Y468 4/20 0.49
GAA P10253 1/20 0.49
HIF1A Q16665 1/20 0.46
UTS2R Q9UKP6 1/20 0.46
MAPK1 P28482 2/20 0.46
EGFR P00533 1/20 0.46
APP P05067 1/20 0.46
METAP1 P53582 3/20 0.45
JAK2 O60674 1/20 0.45
PPP1CA P62136 1/20 0.45

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
SCHEMBL29957028 0.84 EGFR (0.50) RAB9ANPC1KMT2AMEN1LMNA
SCHEMBL31528241 0.76 KAT2B (0.50) KMT2AMEN1KDM4EGAAHPGD
SCHEMBL29641309 0.76 UTS2R (0.45) MAPTKMT2AKDM4ELMNAUTS2R
SCHEMBL15636237 0.76 MAPT (0.73) MAPTRAB9ANPC1KMT2AMEN1
SCHEMBL23426225 0.76 TRIM24 (0.47) MAPTRAB9ANPC1KMT2AMEN1
SCHEMBL18449482 0.74 APP (0.53) MAPTRAB9ANPC1KMT2AMEN1
SCHEMBL9392247 0.74 NPC1 (1.00) MAPTRAB9ANPC1KMT2AMEN1
SCHEMBL3716881 0.74 MAPT (0.70) MAPTRAB9ANPC1KMT2AMEN1
SCHEMBL3288225 0.73 NPC1 (0.63) MAPTRAB9ANPC1KMT2AMEN1
SCHEMBL1376342 0.72 DHODH (0.56) MAPTRAB9ANPC1KMT2AMEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2846803-A1 ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR ALLOSTERIC MODULATORS, THEIR DERIVATIVES AND USES THEREOF Anvyl, LLC (US) 2015-03-18 EP claimed
WO-2013169889-A1 ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR ALLOSTERIC MODULATORS, THEIR DERIVATIVES AND USES THEREOF ANVYL LLC (US) 2013-11-14 WO claimed
EP-2846803-A1 ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR ALLOSTERIC MODULATORS, THEIR DERIVATIVES AND USES THEREOF Anvyl, LLC (US) 2015-03-18 EP disclosed
WO-2013169889-A1 ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR ALLOSTERIC MODULATORS, THEIR DERIVATIVES AND USES THEREOF ANVYL LLC (US) 2013-11-14 WO disclosed