SCHEMBL19089869

SCHEMBL19089869

c1ccc(-c2ccccc2N(c2ccc(-c3ccc(C45CC6CC(CC(C6)C4)C5)cc3)cc2)c2cc3ccccc3c3ccccc23)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ HTT P42858 1/20 0.31
▸ GPR84 Q9NQS5 1/20 0.31
▸ MEN1 O00255 2/20 0.30
▸ KMT2A Q03164 2/20 0.30
▸ POLB P06746 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ GFER P55789 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL19090003 0.92 LMNA (0.37) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL19089838 0.92 LMNA (0.37) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL19089887 0.88 ALDH1A1 (0.34) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL19089848 0.88 ALDH1A1 (0.34) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL19089884 0.87 ALDH1A1 (0.36) ALDH1A1LMNAHTTGPR84MEN1
SCHEMBL19089815 0.87 ALDH1A1 (0.41) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL19090021 0.87 ALDH1A1 (0.41) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL24421886 0.85 ALDH1A1 (0.41) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL24421733 0.85 ALDH1A1 (0.41) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL19089899 0.85 ALDH1A1 (0.33) ALDH1A1LMNAHTTMEN1KMT2A

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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