SCHEMBL28202582

SCHEMBL28202582

C1=CC2=NC1=CC1=NC(=CC3=NC(=CC4=NC(=C2)C=C4)C=C3c2ccccc2)C=C1.CCCCCCl

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.31
▸ PTPN1 P18031 1/20 0.31
▸ TLR8 Q9NR97 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
SCHEMBL28146959 0.83 MAOA (0.31) —
SCHEMBL28306376 0.83 MAOA (0.31) —
SCHEMBL28187477 0.83 MAOA (0.31) —
SCHEMBL11331090 0.83 MAOA (0.31) —
SCHEMBL28201338 0.80 TSHR (0.44) —
SCHEMBL28115330 0.77 MAOA (0.30) —
Formic Acid SCHEMBL28307261 0.77 MAOA (0.30) —
SCHEMBL27742194 0.76 NR1H2 (0.35) HSD11B1PTPN1TLR8
SCHEMBL28169162 0.75 PDE5A (0.39) TLR8
SCHEMBL28019878 0.75 NR1H2 (0.37) HSD11B1PTPN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107828066-A Porphyrin modified metal organic frame nano material of four sulfydryls and its production and use 山东师范大学 2018-03-23 — — CN disclosed
CN-107759803-A A kind of four sulfydryl porphyrin compounds and its production and use 山东师范大学 2018-03-06 — — CN disclosed
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