SCHEMBL19089815

SCHEMBL19089815

c1ccc(-c2ccc(N(c3ccc(-c4ccc(C56CC7CC(CC(C7)C5)C6)cc4)cc3)c3ccccc3-c3ccccc3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.41
▸ LMNA P02545 4/20 0.41
▸ MEN1 O00255 4/20 0.37
▸ KMT2A Q03164 4/20 0.37
▸ NPSR1 Q6W5P4 3/20 0.37
▸ GRIN2D O15399 1/20 0.37
▸ GRIN3B O60391 1/20 0.37
▸ GRIN1 Q05586 1/20 0.37
▸ GRIN2A Q12879 1/20 0.37
▸ GRIN2B Q13224 1/20 0.37
▸ GRIN2C Q14957 1/20 0.37
▸ GRIN3A Q8TCU5 1/20 0.37
▸ EPHX2 P34913 3/20 0.36
▸ HTT P42858 2/20 0.36
▸ POLB P06746 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ GFER P55789 1/20 0.36
▸ HSD11B1 P28845 1/20 0.35
▸ SIGMAR1 Q99720 1/20 0.35
▸ NPC1 O15118 1/20 0.35

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
SCHEMBL19090021 1.00 ALDH1A1 (0.41) ALDH1A1LMNAMEN1KMT2ANPSR1
SCHEMBL24421886 0.99 ALDH1A1 (0.41) ALDH1A1LMNAMEN1KMT2ANPSR1
SCHEMBL24421733 0.99 ALDH1A1 (0.41) ALDH1A1LMNAMEN1KMT2ANPSR1
SCHEMBL23691176 0.97 LMNA (0.44) ALDH1A1LMNAMEN1KMT2ANPSR1
SCHEMBL19089923 0.93 ALDH1A1 (0.36) ALDH1A1LMNAMEN1KMT2ANPSR1
SCHEMBL22815377 0.92 ALDH1A1 (0.35) ALDH1A1LMNAMEN1KMT2ANPSR1
SCHEMBL19089842 0.91 ALDH1A1 (0.35) ALDH1A1LMNAMEN1KMT2ANPSR1
SCHEMBL19089887 0.89 ALDH1A1 (0.34) ALDH1A1LMNAMEN1KMT2ANPSR1
SCHEMBL19089848 0.89 ALDH1A1 (0.34) ALDH1A1LMNAMEN1KMT2ANPSR1
SCHEMBL19089900 0.89 ALDH1A1 (0.40) ALDH1A1LMNAMEN1KMT2ANPSR1

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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