SCHEMBL16487808

SCHEMBL16487808

CCc1cc2nc(-c3cccc(C)c3C)ccc2cc1OC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 5/20 0.41
PDCD1LG2 Q9BQ51 4/20 0.41
MCHR1 Q99705 1/20 0.38
NOS1 P29475 4/20 0.38
NOS3 P29474 3/20 0.38
AVPR2 P30518 1/20 0.38
OXTR P30559 1/20 0.38
S1PR1 P21453 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
PDCD1 Q15116 1/20 0.36
NUDT1 P36639 2/20 0.36
AR P10275 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL13870936 0.86 PDGFRB (0.45) CD274PDCD1LG2MCHR1MAOAMAOB
SCHEMBL13870956 0.84 NUDT1 (0.39) CD274PDCD1LG2AVPR2OXTRS1PR1
SCHEMBL16487809 0.83 TAAR1 (0.36) NOS1NOS3MAOAMAOBMEN1
SCHEMBL16487811 0.81 KMT2A (0.39) MAOBMEN1KMT2A
SCHEMBL16487807 0.81 KMT2A (0.40) MCHR1MEN1KMT2A
SCHEMBL16487817 0.80 CD274 (0.39) CD274PDCD1LG2MCHR1AVPR2OXTR
SCHEMBL16487825 0.78 SMN1; SMN2 (0.44) MEN1KMT2A
SCHEMBL16487813 0.78 ALDH1A1 (0.40) CD274PDCD1LG2MCHR1S1PR1NUDT1
SCHEMBL13870902 0.77 NUDT1 (0.44) S1PR1NUDT1ARMEN1KMT2A
SCHEMBL16487823 0.76 KDM4E (0.45) MCHR1

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-8956737-B2 Red phosphorescent compound and organic electroluminescent device using the same LG DISPLAY CO., LTD. (KR) 2015-02-17 US disclosed