SCHEMBL29886157

SCHEMBL29886157

O=C1C(=O)c2ccc(N3c4ccccc4Oc4ccccc43)nc2-c2nc(N3c4ccccc4Oc4ccccc43)ccc21

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ P2RX4 Q99571 11/20 0.37
▸ MAPT P10636 3/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ALOX5 P09917 1/20 0.32
▸ PDE4B Q07343 1/20 0.32
▸ CTSL P07711 1/20 0.32
▸ PTPRC P08575 1/20 0.32
▸ CTSS P25774 1/20 0.32
▸ PTPN13 Q12923 1/20 0.32
▸ LMNA P02545 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
SCHEMBL28861224 0.91 TDP2 (0.49) TDP1MEN1ALDH1A1KMT2ACTSL
SCHEMBL22580818 0.76 PGR (0.37) MAPTSMN1; SMN2NPSR1MEN1ALDH1A1
SCHEMBL17189491 0.76 P2RX4 (0.41) P2RX4MAPTSMN1; SMN2NPSR1ALOX5
SCHEMBL29886033 0.75 P2RX4 (0.38) P2RX4MAPTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL29655689 0.71 P2RX4 (0.41) P2RX4MAPTL3MBTL1SMN1; SMN2NPSR1
SCHEMBL12150701 0.70 P2RX4 (0.38) P2RX4MAPTSMN1; SMN2NPSR1
SCHEMBL28627472 0.69 DNMT1 (0.38) P2RX4MAPTTDP1SMN1; SMN2NPSR1
SCHEMBL18807298 0.69 P2RX4 (0.33) P2RX4MAPTSMN1; SMN2NPSR1MEN1
SCHEMBL28628168 0.68 POLB (0.41) P2RX4MAPTL3MBTL1TDP1SMN1; SMN2
SCHEMBL17952815 0.67 CHRNA7 (0.39) P2RX4MAPTSMN1; SMN2NPSR1ALOX5

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
CN-115215865-A Thermal-activation delayed fluorescence red light material and preparation method and application thereof 广东工业大学 2022-10-21 — — CN disclosed
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