SCHEMBL20643276

SCHEMBL20643276

CC/C=C\Cc1cccc(-c2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AGXT P21549 2/20 0.50
MAOB P27338 1/20 0.50
BCL2 P10415 1/20 0.44
PTGS2 P35354 2/20 0.42
AOC3 Q16853 3/20 0.40
GPR52 Q9Y2T5 1/20 0.39
GGPS1 O95749 2/20 0.38
HRH3 Q9Y5N1 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
CYP19A1 P11511 1/20 0.38
GPR84 Q9NQS5 1/20 0.38
PRMT6 Q96LA8 1/20 0.38
IDH1 O75874 1/20 0.37
PTGES O14684 1/20 0.37

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
SCHEMBL27486985 0.83 AGXT (0.56) AGXTMAOBBCL2PTGS2AOC3
SCHEMBL28351857 0.82 MAOB (0.56) AGXTMAOB
SCHEMBL18648467 0.82 MAOB (0.75) MAOB
SCHEMBL106917 0.82 MAOB (0.75) MAOB
SCHEMBL106848 0.82 MAOB (0.75) MAOB
SCHEMBL10446475 0.77 ALDH1A1 (0.50) MAOBPTGS2PTGES
SCHEMBL10446472 0.77 ALDH1A1 (0.50) MAOBPTGS2PTGES
SCHEMBL8845072 0.77 IDO1 (0.50) MAOBHRH3CYP11B1CYP11B2GPR84
SCHEMBL28043124 0.76 AGXT (0.49) AGXTMAOBBCL2PTGS2AOC3
SCHEMBL1420024 0.76 AGXT (0.52) AGXTBCL2PTGS2AOC3GPR52

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-3855519-A2 STABLE AND EFFICIENT ELECTROLUMINESCENT MATERIALS Universal Display Corporation (US) 2021-07-28 EP disclosed
EP-3428986-A1 STABLE AND EFFICIENT ELECTROLUMINESCENT MATERIALS Universal Display Corporation (US) 2019-01-16 EP disclosed