SCHEMBL19335980

SCHEMBL19335980

O=C1C=CC(=O)N1c1cc2c(ccc3cc(O)c(N4C(=O)C=CC4=O)cc32)cc1O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TLR9 Q9NR96 4/20 0.43
▸ MGLL Q99685 13/20 0.39
▸ HSP90AA1 P07900 4/20 0.39
▸ NPSR1 Q6W5P4 3/20 0.39
▸ PKM P14618 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ FAAH O00519 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.35
▸ ATM Q13315 2/20 0.35
▸ CCR6 P51684 1/20 0.35
▸ G6PD P11413 1/20 0.35
▸ MITF O75030 1/20 0.33
▸ HTT P42858 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
SCHEMBL31179974 0.79 TLR9 (0.48) TLR9MGLLHSP90AA1NPSR1PKM
SCHEMBL19333571 0.73 HSP90AA1 (0.58) TLR9MGLLHSP90AA1NPSR1PKM
SCHEMBL11647371 0.69 HSP90AA1 (0.54) TLR9MGLLHSP90AA1NPSR1PKM
SCHEMBL21972845 0.69 TLR9 (0.39) TLR9MGLLHSP90AA1NPSR1PKM
SCHEMBL28760463 0.68 HTR5A (0.51) TLR9MGLLHSP90AA1NPSR1PKM
SCHEMBL142504 0.67 TLR9 (0.70) TLR9MGLLHSP90AA1NPSR1PKM
SCHEMBL29366386 0.67 TLR9 (0.70) TLR9MGLLHSP90AA1NPSR1PKM
SCHEMBL24939676 0.67 MYC (0.56) TLR9HSP90AA1NPSR1PKMTDP1
SCHEMBL10885514 0.67 TLR9 (0.41) TLR9MGLLHSP90AA1NPSR1PKM
SCHEMBL21888605 0.66 ESR1 (0.48) TLR9MGLLHSP90AA1NPSR1PKM

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
US-9761804-B2 Oligomeric organic light emitting diode (OLED) materials containing multiple crosslinking functions LOMOX LIMITED (GB) 2017-09-12 — — US disclosed
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