SCHEMBL24889934

SCHEMBL24889934

c1ccc(C2N=C(c3ccc4ccccc4c3)NC(c3cccc(-c4cccc5oc6cc(-c7ccc8ccccc8c7)ccc6c45)c3)N2)cc1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ HCRTR1 O43613 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 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
SCHEMBL24357366 0.93 HCRTR1 (0.31) HCRTR1ALDH1A1MAPT
SCHEMBL24357377 0.92 HCRTR1 (0.31) HCRTR1
SCHEMBL24356806 0.92 HCRTR1 (0.31) HCRTR1
SCHEMBL24890270 0.91 ALDH1A1 (0.31) ALDH1A1MAPT
SCHEMBL24356450 0.91 HCRTR1 (0.33) HCRTR1
SCHEMBL24948022 0.90 ALDH1A1 (0.31) HCRTR1ALDH1A1MAPT
SCHEMBL24356813 0.89 PIM1 (0.32) —
SCHEMBL24890297 0.88 ALDH1A1 (0.31) ALDH1A1MAPT
SCHEMBL24356474 0.87 HCRTR1 (0.31) HCRTR1ALDH1A1MAPT
SCHEMBL24886817 0.87 BACE1 (0.32) ALDH1A1MAPT

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-2023287228-A1 ORGANIC LIGHT EMITTING DEVICE 주식회사 엘지화학 2023-01-19 — — WO disclosed
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