SCHEMBL24570791

SCHEMBL24570791

Clc1ccc(-c2cccc(C3N=C(c4ccccc4)N=C(c4ccccc4)N3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ HTR2C P28335 1/20 0.38
▸ P2RX7 Q99572 2/20 0.35
▸ MAPK13 O15264 1/20 0.34
▸ GCGR P47871 1/20 0.34
▸ MAPK12 P53778 1/20 0.34
▸ MAPK11 Q15759 1/20 0.34
▸ MAPK14 Q16539 1/20 0.34
▸ CNR1 P21554 2/20 0.34
▸ RPS6KA3 P51812 1/20 0.34
▸ MAOB P27338 2/20 0.34
▸ MAOA P21397 1/20 0.34
▸ CTRC Q99895 1/20 0.33
▸ MECP2 P51608 1/20 0.33
▸ MBD2 Q9UBB5 1/20 0.33
▸ MAP4K4 O95819 1/20 0.33
▸ GRIN2B Q13224 1/20 0.32
▸ APAF1 O14727 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
SCHEMBL15860723 0.92 CYP1A2 (0.39) MAPTTP53CYP1A2HTR2CP2RX7
SCHEMBL18931268 0.92 CYP1A2 (0.43) MAPTTP53CYP1A2P2RX7RPS6KA3
SCHEMBL19452813 0.91 MAPT (0.43) MAPTTP53P2RX7RPS6KA3MAOB
SCHEMBL19688406 0.91 TP53 (0.40) MAPTTP53P2RX7RPS6KA3MAOB
SCHEMBL17876746 0.91 MAPT (0.40) MAPTTP53CYP1A2P2RX7RPS6KA3
SCHEMBL19007150 0.90 TP53 (0.39) MAPTTP53P2RX7RPS6KA3MAOB
SCHEMBL19688637 0.90 TP53 (0.42) MAPTTP53P2RX7RPS6KA3MAOB
SCHEMBL24570004 0.90 TP53 (0.42) MAPTTP53P2RX7RPS6KA3MAOB
SCHEMBL19688114 0.90 CYP1A2 (0.39) MAPTTP53CYP1A2HTR2CP2RX7
SCHEMBL18560838 0.89 NISCH (0.38) MAPTP2RX7NOS2

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-2022139455-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 솔루스첨단소재 주식회사 2022-06-30 — — WO disclosed
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