SCHEMBL15046419

SCHEMBL15046419

CC(C)(C)c1ccc(N2c3ccccc3C(C)(C)c3cc(/C=C/c4ccc5c(c4)C(C)(C)c4ccccc4N5c4ccccc4)ccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H3 Q13133 2/20 0.40
▸ NR1H2 P55055 1/20 0.40
▸ HTT P42858 3/20 0.34
▸ POLB P06746 2/20 0.34
▸ TRPV1 Q8NER1 1/20 0.32
▸ PDK2 Q15119 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ ESR1 P03372 1/20 0.32
▸ MAPT P10636 5/20 0.31
▸ MEN1 O00255 3/20 0.31
▸ MAPK1 P28482 3/20 0.31
▸ KMT2A Q03164 3/20 0.31
▸ THRB P10828 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ LMNA P02545 2/20 0.31
▸ GAA P10253 2/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ P2RY1 P47900 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
SCHEMBL15046355 0.92 NR1H2 (0.39) NR1H3NR1H2HTTPOLBPDK2
SCHEMBL15046420 0.90 NR1H2 (0.40) NR1H3NR1H2HTTPOLBPDK2
SCHEMBL15046228 0.90 PGR (0.38) NR1H3HTTPOLBPDK2PGR
SCHEMBL15118493 0.88 NR1H2 (0.38) NR1H3NR1H2HTTPOLBPGR
SCHEMBL15046396 0.86 PTPN1 (0.35) NR1H3HTTPOLBPDK2PGR
SCHEMBL15046421 0.86 NR1H2 (0.33) NR1H3NR1H2
SCHEMBL16940893 0.86 ITGB2 (0.39) NR1H3HTTPGRMAPTMEN1
SCHEMBL15118492 0.86 ITGB2 (0.36) NR1H3NR1H2PGRKMT2ANPSR1
SCHEMBL15046239 0.85 NR1H2 (0.39) NR1H3NR1H2TRPV1PDK2ESR1
SCHEMBL15046250 0.85 NR1H2 (0.39) NR1H3NR1H2TRPV1PDK2ESR1

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-2013089460-A1 NOVEL CHEMICAL COMPOUND HAVING AN ACRIDINE STRUCTURE, AND ORGANIC LIGHT-EMITTING DIODE USING SAME 주식회사 두산 (KR) 2013-06-20 — — WO disclosed
Send feedback