SCHEMBL8046949

SCHEMBL8046949

Nc1cc(F)cc2c1OC(COC1CCCCO1)CC2

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
KDM4C Q9H3R0 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL8044902 0.82 L3MBTL1 (0.35) L3MBTL1KDM4C
SCHEMBL8045648 0.82 L3MBTL1 (0.35) L3MBTL1
SCHEMBL10508354 0.74 CA2 (0.38) L3MBTL1KDM4CNPC1RAB9A
SCHEMBL26126355 0.69 CYP1A2 (0.37) L3MBTL1KDM4CNPC1RAB9A
SCHEMBL283701 0.69 CYP1A2 (0.37) L3MBTL1KDM4CNPC1RAB9A
SCHEMBL25366018 0.66 L3MBTL1 (0.32) L3MBTL1
SCHEMBL10506002 0.66 PRMT5 (0.35) NPC1RAB9A
SCHEMBL10987183 0.65 L3MBTL1 (0.47) L3MBTL1KDM4CNPC1RAB9A
SCHEMBL7979466 0.65 MEN1 (0.37) L3MBTL1KDM4CNPC1RAB9A
SCHEMBL19297387 0.65 LMNA (0.41) KDM4CNPC1RAB9A

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-6100268-A MIGRAINES JANSSEN PHARMACEUTICA, N.V. (BE) 2000-08-08 US disclosed