SCHEMBL19089884

SCHEMBL19089884

c1ccc(-c2ccc(N(c3ccc(-c4ccc(C56CC7CC(CC(C7)C5)C6)cc4)cc3)c3ccc(-c4cc5ccccc5c5ccccc45)cc3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ CYP11B1 P15538 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MPI P34949 1/20 0.35
▸ HTT P42858 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ GFER P55789 1/20 0.34
▸ GPR84 Q9NQS5 2/20 0.34
▸ AKT1 P31749 1/20 0.33
▸ 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

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
SCHEMBL21203667 0.92 MEN1 (0.37) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL21203576 0.90 ALDH1A1 (0.40) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL19090003 0.89 LMNA (0.37) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL19089838 0.89 LMNA (0.37) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL19089899 0.89 ALDH1A1 (0.33) ALDH1A1LMNACYP11B1MEN1KMT2A
SCHEMBL19089869 0.87 ALDH1A1 (0.32) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL19089825 0.87 CA12 (0.37) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL19089905 0.87 CA12 (0.37) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL25909581 0.86 CHRNA1 (0.31) ALDH1A1LMNAHPGD
SCHEMBL21203528 0.86 HSD17B1 (0.37) ALDH1A1LMNAMEN1KMT2AKDM4E

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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