SCHEMBL4755285

SCHEMBL4755285

O=CCN1CCN(c2nc(-c3ccccc3F)nc3cccc(Cl)c23)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.52
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
HIF1A Q16665 2/20 0.47
LMNA P02545 3/20 0.42
ABCB1 P08183 1/20 0.42
ELANE P08246 1/20 0.42
TDP1 Q9NUW8 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ALDH1A1 P00352 3/20 0.40
TSHR P16473 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KDM4E B2RXH2 2/20 0.38
GAA P10253 2/20 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
SCHEMBL4753657 0.92 MEN1 (0.52) MAPTMEN1KMT2AHIF1ALMNA
SCHEMBL4753852 0.92 MAPT (0.50) MAPTMEN1KMT2AHIF1ALMNA
SCHEMBL4753636 0.92 KMT2A (0.55) MAPTMEN1KMT2AHIF1ALMNA
SCHEMBL4755874 0.84 HIF1A (0.67) MAPTMEN1KMT2AHIF1ALMNA
SCHEMBL4754220 0.84 MEN1 (0.54) MAPTMEN1KMT2ALMNAABCB1
SCHEMBL4099494 0.84 HIF1A (0.65) MAPTMEN1KMT2AHIF1ALMNA
SCHEMBL4756771 0.83 MEN1 (0.49) MAPTMEN1KMT2AABCB1TDP1
SCHEMBL4753835 0.81 MEN1 (0.52) MAPTMEN1KMT2AHIF1ALMNA
SCHEMBL4756892 0.81 MAPT (0.61) MAPTMEN1KMT2AHIF1ALMNA
SCHEMBL4095765 0.80 MAPT (0.53) MAPTMEN1KMT2AHIF1ALMNA

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
WO-2008157500-A1 AMINOQUINAZOLINE CANNABINOID RECEPTOR MODULATORS FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2008-12-24 WO disclosed