SCHEMBL19089838

SCHEMBL19089838

c1ccc(-c2ccc(N(c3ccc(-c4ccc(C56CC7CC(CC(C7)C5)C6)cc4)cc3)c3cc4ccccc4c4ccccc34)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ HTT P42858 3/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ GAA P10253 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ GFER P55789 1/20 0.35
▸ GRIN2D O15399 1/20 0.33
▸ GRIN3B O60391 1/20 0.33
▸ GRIN1 Q05586 1/20 0.33
▸ GRIN2A Q12879 1/20 0.33
▸ GRIN2B Q13224 1/20 0.33
▸ GRIN2C Q14957 1/20 0.33
▸ GRIN3A Q8TCU5 1/20 0.33
▸ EPHX2 P34913 3/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HSD11B1 P28845 1/20 0.32
▸ PGR P06401 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
SCHEMBL19090003 1.00 LMNA (0.37) LMNAALDH1A1HTTMEN1KMT2A
SCHEMBL19089869 0.92 ALDH1A1 (0.32) LMNAALDH1A1HTTMEN1KMT2A
SCHEMBL21039132 0.92 HTT (0.33) HTTMEN1KMT2AGAAPOLB
SCHEMBL19089884 0.89 ALDH1A1 (0.36) LMNAALDH1A1HTTMEN1KMT2A
SCHEMBL19089881 0.89 GPR84 (0.34) LMNAALDH1A1HTTMEN1KMT2A
SCHEMBL19089899 0.88 ALDH1A1 (0.33) LMNAALDH1A1HTTMEN1KMT2A
SCHEMBL19098525 0.84 — —
SCHEMBL19098336 0.84 — —
SCHEMBL21203667 0.83 MEN1 (0.37) LMNAALDH1A1HTTMEN1KMT2A
SCHEMBL24421883 0.83 LMNA (0.37) LMNAALDH1A1HTTMEN1KMT2A

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
Send feedback