SCHEMBL28834366

SCHEMBL28834366

NC(=O)OCc1cc(-n2ccnc2)nnc1Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ LOXL2 Q9Y4K0 1/20 0.35
▸ STING1 Q86WV6 1/20 0.34
▸ IDO1 P14902 3/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ ADH5 P11766 3/20 0.33
▸ ICAM1 P05362 1/20 0.32
▸ SELE P16581 1/20 0.32
▸ VCAM1 P19320 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MITF O75030 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ ENPP2 Q13822 1/20 0.31
▸ MKNK1 Q9BUB5 1/20 0.31
▸ MKNK2 Q9HBH9 1/20 0.31
▸ LSS P48449 1/20 0.31

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
SCHEMBL28834317 0.79 IDO1 (0.35) MAPTMEN1KMT2AIDO1SMN1; SMN2
SCHEMBL23015336 0.76 STING1 (0.39) MAPTMEN1KMT2ASTING1IDO1
SCHEMBL28834293 0.75 TDP1 (0.39) MEN1KMT2AALDH1A1HTTLMNA
SCHEMBL29742187 0.73 L3MBTL1 (0.42) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL23024832 0.73 L3MBTL1 (0.42) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL8889331 0.63 POLB (0.53) MAPTLOXL2IDO1SMN1; SMN2ADH5
SCHEMBL23024698 0.62 STING1 (0.51) MAPTMEN1KMT2ALOXL2STING1
SCHEMBL14114863 0.62 ALDH1A1 (0.42) MAPTMEN1KMT2ASMN1; SMN2ICAM1
SCHEMBL16314611 0.62 ALDH1A1 (0.50) ALDH1A1
SCHEMBL29030119 0.62 IDO1 (0.47) MAPTMEN1KMT2AIDO1ALDH1A1

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-114981256-A Single-ring agonists of the interferon gene stimulator STING 斯克里普斯研究学院 2022-08-30 — — CN disclosed
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