SCHEMBL19089842

SCHEMBL19089842

c1ccc(-c2ccccc2N(c2ccc(-c3ccc(C45CC6CC(CC(C6)C4)C5)cc3)cc2)c2ccc3ccccc3c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.35
▸ LMNA P02545 2/20 0.35
▸ PRMT5 O14744 1/20 0.34
▸ WDR77 Q9BQA1 1/20 0.34
▸ MEN1 O00255 5/20 0.33
▸ KMT2A Q03164 5/20 0.33
▸ HTT P42858 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ NR2E1 Q9Y466 1/20 0.33
▸ POLB P06746 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ GFER P55789 1/20 0.33
▸ RARB P10826 3/20 0.32
▸ RARG P13631 3/20 0.32
▸ MAPT P10636 2/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ EPHX2 P34913 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ TP53 P04637 1/20 0.32

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
SCHEMBL19089804 0.94 MEN1 (0.36) ALDH1A1LMNAPRMT5WDR77MEN1
SCHEMBL19089837 0.91 ALDH1A1 (0.40) ALDH1A1LMNAPRMT5WDR77MEN1
SCHEMBL19090021 0.91 ALDH1A1 (0.41) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL19089815 0.91 ALDH1A1 (0.41) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL24421886 0.89 ALDH1A1 (0.41) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL24421733 0.89 ALDH1A1 (0.41) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL24421738 0.89 ALDH1A1 (0.35) ALDH1A1LMNAPRMT5WDR77MEN1
SCHEMBL19089923 0.88 ALDH1A1 (0.36) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL23691176 0.88 LMNA (0.44) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL24421727 0.87 ALDH1A1 (0.41) ALDH1A1LMNAMEN1KMT2AHTT

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-2017116168-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 머티어리얼사이언스 주식회사 2017-07-06 — — WO disclosed
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